CP2K update check started on merlin-l-001.psi.ch at 2022-03-08 22:19:14+01:00 for rt-Linux-gnu-x86_64-latest-mpich-psmp Fetching origin From https://github.com/cp2k/cp2k 95ff93a60..76175a888 master -> origin/master Fetching submodule exts/dbcsr Fetching submodule exts/dbcsr/tools/build_utils/fypp Fetching submodule tools/prettify/fprettify Fetching submodule exts/dbcsr Fetching submodule exts/dbcsr/tools/build_utils/fypp Fetching submodule tools/prettify/fprettify Updating 95ff93a60..76175a888 Fast-forward src/dbm/dbm_multiply.c | 17 +++++++++++------ 1 file changed, 11 insertions(+), 6 deletions(-) Fetching origin Fetching submodule exts/dbcsr Fetching submodule exts/dbcsr/tools/build_utils/fypp Fetching submodule tools/prettify/fprettify Fetching submodule exts/dbcsr Fetching submodule exts/dbcsr/tools/build_utils/fypp Fetching submodule tools/prettify/fprettify Fetching origin Fetching submodule exts/dbcsr Fetching submodule exts/dbcsr/tools/build_utils/fypp Fetching submodule tools/prettify/fprettify Fetching submodule exts/dbcsr Fetching submodule exts/dbcsr/tools/build_utils/fypp Fetching submodule tools/prettify/fprettify Already up to date. CommitSHA: 76175a888b462bc5fee4cca588a6905157cc7582 CommitTime: 2022-03-08 22:15:34 +0100 CommitAuthor: Ole Schütt CommitAuthorEmail: ole.schuett@cp2k.org CommitSubject: DBM: Implement retain_sparsity for dbm_multiply # CP2K source was changed CommitSHA: 76175a888b462bc5fee4cca588a6905157cc7582 CommitDate: 2022-03-08 CommitTime: 22:15:34 Starting batch job rt-Linux-gnu-x86_64-latest-mpich-psmp with the job id 1433585 (merlin) on cluster merlin6 at Tue Mar 8 22:19:33 CET 2022 44 tasks with 1 tasks per core and 2 threads per task have been allocated on 1 nodes Node list: merlin-c-223 WARNING: (./install_cp2k_toolchain.sh, line 338) No MPI installation detected (ignore this message in Cray Linux Environment or when MPI installation was requested). You have chosen to install the GCC compiler, therefore MPI libraries have to be installed too and the use of the Intel compiler and Intel MPI will be disabled. Compiling with 88 processes. ==================== Installing GCC ==================== gcc-11.2.0 is already installed, skipping it. gcc is installed as /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gcc-11.2.0/bin/gcc g++ is installed as /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gcc-11.2.0/bin/g++ gfortran is installed as /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gcc-11.2.0/bin/gfortran Step gcc took 0.00 seconds. Step intel took 0.00 seconds. ==================== Getting proc arch info using OpenBLAS tools ==================== OpenBLAS detected LIBCORE = haswell OpenBLAS detected ARCH = x86_64 ==================== Installing CMake ==================== cmake-3.22.1 is already installed, skipping it. Step cmake took 0.00 seconds. ==================== Installing MPICH ==================== mpich-3.3.2 is already installed, skipping it. Found directory /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/mpich-3.3.2/bin Found directory /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/mpich-3.3.2/lib Found directory /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/mpich-3.3.2/include mpirun is installed as /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/mpich-3.3.2/bin/mpirun mpicc is installed as /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/mpich-3.3.2/bin/mpicc mpicxx is installed as /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/mpich-3.3.2/bin/mpicxx mpif90 is installed as /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/mpich-3.3.2/bin/mpif90 Step mpich took 0.00 seconds. ==================== Installing OpenBLAS ==================== openblas-0.3.19 is already installed, skipping it. Step openblas took 0.00 seconds. ==================== Installing FFTW ==================== fftw-3.3.10 is already installed, skipping it. Step fftw took 0.00 seconds. ==================== Installing LIBINT ==================== libint-2.6.0 is already installed, skipping it. Step libint took 1.00 seconds. ==================== Installing LIBXC ==================== libxc-5.2.2 is already installed, skipping it. Step libxc took 0.00 seconds. ==================== Installing libsmm ==================== libsmm is already installed, skipping it. Step libsmm took 0.00 seconds. ==================== Installing Libxsmm ==================== libxsmm-1.17 is already installed, skipping it. Step libxsmm took 0.00 seconds. ==================== Installing ScaLAPACK ==================== scalapack-2.1.0 is already installed, skipping it. Step scalapack took 0.00 seconds. ==================== Installing COSMA ==================== COSMA-2.5.1 is already installed, skipping it. Step cosma took 0.00 seconds. ==================== Installing ELPA ==================== elpa-2021.11.002 is already installed, skipping it. Step elpa took 0.00 seconds. ==================== Installing PT-Scotch ==================== scotch-6.0.0 is already installed, skipping it. Step ptscotch took 0.00 seconds. ==================== Installing SuperLU_DIST ==================== superlu_dist-6.1.0 is already installed, skipping it. Step superlu took 1.00 seconds. ==================== Installing PEXSI ==================== pexsi_dist-1.2.0 is already installed, skipping it. Step pexsi took 0.00 seconds. ==================== Installing QUIP ==================== quip_dist-b4336484fb65b0e73211a8f920ae4361c7c353fd is already installed, skipping it. Step quip took 0.00 seconds. ==================== Installing gsl ==================== gsl-2.7 is already installed, skipping it. Step gsl took 0.00 seconds. ==================== Installing PLUMED ==================== plumed-2.7.3 is already installed, skipping it. Step plumed took 0.00 seconds. ==================== Installing hdf5 ==================== hdf5-1.12.0 is already installed, skipping it. Step hdf5 took 0.00 seconds. ==================== Installing libvdwxc ==================== libvdwxc-0.4.0 is already installed, skipping it. Step libvdwxc took 0.00 seconds. ==================== Installing spglib ==================== spglib-1.16.2 is already installed, skipping it. Step spglib took 1.00 seconds. ==================== Installing libvori ==================== libvori-210412 is already installed, skipping it. Step libvori took 0.00 seconds. ==================== Installing spfft ==================== SpFFT-1.0.5 is already installed, skipping it. Step spfft took 0.00 seconds. ==================== Installing spla ==================== SpLA-1.5.3 is already installed, skipping it. Step spla took 0.00 seconds. ==================== Installing SIRIUS ==================== sirius_dist-7.3.1 is already installed, skipping it. Step sirius took 0.00 seconds. ==================== generating arch files ==================== arch files can be found in the /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch subdirectory Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local.ssmp Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local_static.ssmp Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local.sdbg Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local_coverage.sdbg Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local.psmp Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local.pdbg Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local_static.psmp Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local_warn.psmp Wrote /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/local_coverage.pdbg ========================== usage ========================= Done! Now copy: cp /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/arch/* to the cp2k/arch/ directory To use the installed tools and libraries and cp2k version compiled with it you will first need to execute at the prompt: source /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/setup To build CP2K you should change directory: cd cp2k/ make -j 88 ARCH=local VERSION="ssmp sdbg psmp pdbg" arch files for GPU enabled CUDA versions are named "local_cuda.*" arch files for GPU enabled HIP versions are named "local_hip.*" arch files for coverage versions are named "local_coverage.*" Note that these pre-built arch files are for the GNU compiler, users have to adapt them for other compilers. It is possible to use the provided CP2K arch files as guidance. Check the output above for error messages and consistency! If everything is OK, you can build a CP2K production binary with make -j ARCH=Linux-gnu-x86_64 VERSION=psmp Alternatively, you can add further checks, e.g. for regression testing, with make -j ARCH=Linux-gnu-x86_64 VERSION=psmp DO_CHECKS=yes or build CP2K only with shared libraries using make -j ARCH=Linux-gnu-x86_64 VERSION=psmp SHARED=yes or build CP2K as a library with make -j ARCH=Linux-gnu-x86_64 VERSION=psmp libcp2k --------------------------------- Git ---------------------------------- CommitSHA: 76175a888b462bc5fee4cca588a6905157cc7582 Commmit SHA of submodule in tools/prettify/fprettify: 71781aaaa0cd513e0e25093a3b69fbdd778e8409 Commmit SHA of submodule in exts/dbcsr: f4df17b0f1fc9675fcfb66535fd99bf4dc2a8d0a Commmit SHA of submodule in exts/dbcsr/modules/tools/build_utils/fypp: 7895a7efb7d2f07dc284cece6cc9474297b8dc55 CommitTime: 2022-03-08 22:15:34 +0100 CommitAuthor: Ole Schütt CommitAuthorEmail: ole.schuett@cp2k.org CommitSubject: DBM: Implement retain_sparsity for dbm_multiply -------------------------- Resource limits ----------------------------- RESOURCE DESCRIPTION SOFT HARD UNITS AS address space limit unlimited unlimited bytes CORE max core file size 0 unlimited blocks CPU CPU time unlimited unlimited seconds DATA max data size unlimited unlimited bytes FSIZE max file size unlimited unlimited blocks LOCKS max number of file locks held unlimited unlimited MEMLOCK max locked-in-memory address space unlimited unlimited bytes MSGQUEUE max bytes in POSIX mqueues 819200 819200 bytes NICE max nice prio allowed to raise 0 0 NOFILE max number of open files 131072 131072 NPROC max number of processes 1543860 1543860 RSS max resident set size 369098752000 369098752000 pages RTPRIO max real-time priority 0 0 RTTIME timeout for real-time tasks unlimited unlimited microsecs SIGPENDING max number of pending signals 1543860 1543860 STACK max stack size unlimited unlimited bytes ------------------------------- SELinux -------------------------------- SELinux is installed and is Permissive ------------------------------ Arch file ------------------------------- #!/bin/bash # # CP2K (GNU x86_64) arch file for Linux clusters # # Tested with: GNU 10.3.0 (and 11.2.0), MPICH 3.3.2 (and OpenMPI 4.1.1), # ScaLAPACK 2.1.0, OpenBLAS 0.3.19, FFTW 3.3.10, LIBINT 2.6.0, # LIBXC 5.2.2, ELPA 2021.11.002, PLUMED 2.7.3, SPGLIB 1.16.2, # LIBVORI 210412, GSL 2.7, COSMA 2.5.1, SIRIUS 7.3.1 # on the Merlin cluster (PSI) # # Usage: Source this arch file and then run make as instructed. # A full toolchain installation is performed as default. # Optionally, GNU compiler and MPICH version can be specified as arguments. # Replace or adapt the "module add" commands below if needed. # # Author: Matthias Krack (25.02.2022) # # \ if [[ "${0}" == "${BASH_SOURCE}" ]]; then \ echo "ERROR: Script ${0##*/} must be sourced"; \ echo "Usage: source ${0##*/}"; \ exit 1; \ fi; \ this_file=${BASH_SOURCE##*/}; \ cd tools/toolchain; \ if [[ -n "${1}" ]]; then \ module add ${1}; \ [[ -n "${2}" ]] && module add ${2}; \ module list; \ ./install_cp2k_toolchain.sh --install-all --with-gcc=system --with-mpich=system; \ else \ ./install_cp2k_toolchain.sh --install-all --with-gcc --with-mpich; \ fi; \ source ./install/setup; \ cd ../..; \ echo; \ echo "Check the output above for error messages and consistency!"; \ echo "If everything is OK, you can build a CP2K production binary with"; \ echo " make -j ARCH=${this_file%%.*} VERSION=${this_file##*.}"; \ echo "Alternatively, you can add further checks, e.g. for regression testing, with"; \ echo " make -j ARCH=${this_file%%.*} VERSION=${this_file##*.} DO_CHECKS=yes"; \ echo "or build CP2K only with shared libraries using"; \ echo " make -j ARCH=${this_file%%.*} VERSION=${this_file##*.} SHARED=yes"; \ echo "or build CP2K as a library with"; \ echo " make -j ARCH=${this_file%%.*} VERSION=${this_file##*.} libcp2k"; \ return # Set options DO_CHECKS := no SHARED := no USE_COSMA := 2.5.1 USE_ELPA := 2021.11.002 USE_FFTW := 3.3.10 USE_LIBINT := 2.6.0 USE_LIBPEXSI := 1.2.0 USE_LIBVORI := 210412 USE_LIBXC := 5.2.2 USE_LIBXSMM := 1.17 USE_OPENBLAS := 0.3.19 USE_PLUMED := 2.7.3 USE_QUIP := b4336484fb65b0e73211a8f920ae4361c7c353fd USE_SCALAPACK := 2.1.0 USE_SIRIUS := 7.3.1 USE_SPGLIB := 1.16.2 # Only needed for SIRIUS LIBVDWXC_VER := 0.4.0 SPFFT_VER := 1.0.5 SPLA_VER := 1.5.2 HDF5_VER := 1.12.0 # Only needed for LIBPEXSI SCOTCH_VER := 6.0.0 SUPERLU_VER := 6.1.0 LMAX := 5 MAX_CONTR := 4 CC := mpicc FC := mpif90 LD := mpif90 AR := ar -r CFLAGS := -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native DFLAGS := -D__parallel DFLAGS += -D__SCALAPACK DFLAGS += -D__HAS_IEEE_EXCEPTIONS DFLAGS += -D__MPI_VERSION=3 DFLAGS += -D__MAX_CONTR=$(strip $(MAX_CONTR)) INSTALL_PATH := $(PWD)/tools/toolchain/install ifeq ($(SHARED), yes) LD_SHARED := $(FC) -shared CFLAGS += -fPIC LDFLAGS := -Wl,--enable-new-dtags CP2K_LIB := $(PWD)/lib/$(ARCH)/$(ONEVERSION) LDFLAGS += -Wl,-rpath=$(CP2K_LIB) LDFLAGS += -Wl,-rpath=$(CP2K_LIB)/exts/dbcsr endif # Settings for regression testing ifeq ($(DO_CHECKS), yes) DFLAGS += -D__CHECK_DIAG FCFLAGS_DEBUG := -fcheck=bounds,do,recursion,pointer FCFLAGS_DEBUG += -fcheck=all,no-array-temps FCFLAGS_DEBUG += -ffpe-trap=invalid,overflow,zero FCFLAGS_DEBUG += -fimplicit-none FCFLAGS_DEBUG += -finit-derived FCFLAGS_DEBUG += -finit-real=snan FCFLAGS_DEBUG += -finit-integer=-42 FCFLAGS_DEBUG += -finline-matmul-limit=0 LDFLAGS += -fsanitize=leak WFLAGS := -Werror=aliasing WFLAGS += -Werror=ampersand WFLAGS += -Werror=c-binding-type WFLAGS += -Werror=conversion WFLAGS += -Werror=intrinsic-shadow WFLAGS += -Werror=intrinsics-std WFLAGS += -Werror=line-truncation WFLAGS += -Wrealloc-lhs WFLAGS += -Werror=tabs WFLAGS += -Werror=target-lifetime WFLAGS += -Werror=underflow WFLAGS += -Werror=unused-but-set-variable WFLAGS += -Werror=unused-dummy-argument WFLAGS += -Werror=unused-variable endif ifneq ($(USE_PLUMED),) USE_PLUMED := $(strip $(USE_PLUMED)) PLUMED_LIB := $(INSTALL_PATH)/plumed-$(USE_PLUMED)/lib DFLAGS += -D__PLUMED2 USE_GSL := 2.7 ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(PLUMED_LIB) -L$(PLUMED_LIB) -lplumed -lplumedKernel else LIBS += $(PLUMED_LIB)/libplumed.a endif endif ifneq ($(USE_ELPA),) USE_ELPA := $(strip $(USE_ELPA)) ELPA_INC := $(INSTALL_PATH)/elpa-$(USE_ELPA)/cpu/include/elpa_openmp-$(USE_ELPA) ELPA_LIB := $(INSTALL_PATH)/elpa-$(USE_ELPA)/cpu/lib CFLAGS += -I$(ELPA_INC)/elpa -I$(ELPA_INC)/modules DFLAGS += -D__ELPA ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(ELPA_LIB) -L$(ELPA_LIB) -lelpa_openmp else LIBS += $(ELPA_LIB)/libelpa_openmp.a endif endif ifneq ($(USE_QUIP),) USE_QUIP := $(strip $(USE_QUIP)) QUIP_INC := $(INSTALL_PATH)/quip-$(USE_QUIP)/include QUIP_LIB := $(INSTALL_PATH)/quip-$(USE_QUIP)/lib CFLAGS += -I$(QUIP_INC) DFLAGS += -D__QUIP LIBS += $(QUIP_LIB)/libquip_core.a LIBS += $(QUIP_LIB)/libatoms.a LIBS += $(QUIP_LIB)/libFoX_sax.a LIBS += $(QUIP_LIB)/libFoX_common.a LIBS += $(QUIP_LIB)/libFoX_utils.a LIBS += $(QUIP_LIB)/libFoX_fsys.a endif ifneq ($(USE_LIBPEXSI),) USE_LIBPEXSI := $(strip $(USE_LIBPEXSI)) SCOTCH_VER := $(strip $(SCOTCH_VER)) SUPERLU_VER := $(strip $(SUPERLU_VER)) LIBPEXSI_INC := $(INSTALL_PATH)/pexsi-$(USE_LIBPEXSI)/include LIBPEXSI_LIB := $(INSTALL_PATH)/pexsi-$(USE_LIBPEXSI)/lib SCOTCH_INC := $(INSTALL_PATH)/scotch-$(SCOTCH_VER)/include SCOTCH_LIB := $(INSTALL_PATH)/scotch-$(SCOTCH_VER)/lib SUPERLU_INC := $(INSTALL_PATH)/superlu_dist-$(SUPERLU_VER)/include SUPERLU_LIB := $(INSTALL_PATH)/superlu_dist-$(SUPERLU_VER)/lib CFLAGS += -I$(LIBPEXSI_INC) -I$(SCOTCH_INC) -I$(SUPERLU_INC) DFLAGS += -D__LIBPEXSI LIBS += $(LIBPEXSI_LIB)/libpexsi.a LIBS += $(SUPERLU_LIB)/libsuperlu_dist.a LIBS += $(SCOTCH_LIB)/libptscotchparmetis.a LIBS += $(SCOTCH_LIB)/libptscotch.a LIBS += $(SCOTCH_LIB)/libptscotcherr.a LIBS += $(SCOTCH_LIB)/libscotchmetis.a LIBS += $(SCOTCH_LIB)/libscotch.a endif ifneq ($(USE_LIBVORI),) USE_LIBVORI := $(strip $(USE_LIBVORI)) LIBVORI_LIB := $(INSTALL_PATH)/libvori-$(USE_LIBVORI)/lib DFLAGS += -D__LIBVORI ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(LIBVORI_LIB) -L$(LIBVORI_LIB) -lvori else LIBS += $(LIBVORI_LIB)/libvori.a endif endif ifneq ($(USE_LIBXC),) USE_LIBXC := $(strip $(USE_LIBXC)) LIBXC_INC := $(INSTALL_PATH)/libxc-$(USE_LIBXC)/include LIBXC_LIB := $(INSTALL_PATH)/libxc-$(USE_LIBXC)/lib CFLAGS += -I$(LIBXC_INC) DFLAGS += -D__LIBXC ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(LIBXC_LIB) -L$(LIBXC_LIB) -lxcf03 -lxc else LIBS += $(LIBXC_LIB)/libxcf03.a LIBS += $(LIBXC_LIB)/libxc.a endif endif ifneq ($(USE_LIBINT),) USE_LIBINT := $(strip $(USE_LIBINT)) LMAX := $(strip $(LMAX)) LIBINT_INC := $(INSTALL_PATH)/libint-v$(USE_LIBINT)-cp2k-lmax-$(LMAX)/include LIBINT_LIB := $(INSTALL_PATH)/libint-v$(USE_LIBINT)-cp2k-lmax-$(LMAX)/lib CFLAGS += -I$(LIBINT_INC) DFLAGS += -D__LIBINT ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(LIBINT_LIB) -L$(LIBINT_LIB) -lint2 else LIBS += $(LIBINT_LIB)/libint2.a LIBS += $(LIBINT_LIB)/libint2.a endif endif ifneq ($(USE_SPGLIB),) USE_SPGLIB := $(strip $(USE_SPGLIB)) SPGLIB_INC := $(INSTALL_PATH)/spglib-$(USE_SPGLIB)/include SPGLIB_LIB := $(INSTALL_PATH)/spglib-$(USE_SPGLIB)/lib CFLAGS += -I$(SPGLIB_INC) DFLAGS += -D__SPGLIB ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(SPGLIB_LIB) -L$(SPGLIB_LIB) -lsymspg else LIBS += $(SPGLIB_LIB)/libsymspg.a endif endif ifneq ($(USE_LIBXSMM),) USE_LIBXSMM := $(strip $(USE_LIBXSMM)) LIBXSMM_INC := $(INSTALL_PATH)/libxsmm-$(USE_LIBXSMM)/include LIBXSMM_LIB := $(INSTALL_PATH)/libxsmm-$(USE_LIBXSMM)/lib CFLAGS += -I$(LIBXSMM_INC) DFLAGS += -D__LIBXSMM ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(LIBXSMM_LIB) -L$(LIBXSMM_LIB) -lxsmmf -lxsmm else LIBS += $(LIBXSMM_LIB)/libxsmmf.a LIBS += $(LIBXSMM_LIB)/libxsmm.a endif endif ifneq ($(USE_SIRIUS),) USE_SIRIUS := $(strip $(USE_SIRIUS)) SIRIUS_INC := $(INSTALL_PATH)/sirius-$(USE_SIRIUS)/include SIRIUS_LIB := $(INSTALL_PATH)/sirius-$(USE_SIRIUS)/lib SPFFT_LIB := $(INSTALL_PATH)/SpFFT-$(SPFFT_VER)/lib SPLA_LIB := $(INSTALL_PATH)/SpLA-$(SPLA_VER)/lib HDF5_LIB := $(INSTALL_PATH)/hdf5-$(HDF5_VER)/lib LIBVDWXC_LIB := $(INSTALL_PATH)/libvdwxc-$(LIBVDWXC_VER)/lib CFLAGS += -I$(SIRIUS_INC) DFLAGS += -D__SPFFT DFLAGS += -D__SPLA DFLAGS += -D__HDF5 DFLAGS += -D__LIBVDWXC DFLAGS += -D__SIRIUS ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(SIRIUS_LIB) -L$(SIRIUS_LIB) -lsirius LIBS += -Wl,-rpath=$(SPFFT_LIB) -L$(SPFFT_LIB) -lspfft LIBS += -Wl,-rpath=$(SPLA_LIB) -L$(SPLA_LIB) -lspla LIBS += -Wl,-rpath=$(HDF5_LIB) -L$(HDF5_LIB) -lhdf5 LIBS += -Wl,-rpath=$(LIBVDWXC_LIB) -L$(LIBVDWXC_LIB) -lvdwxc else LIBS += $(SIRIUS_LIB)/libsirius.a LIBS += $(SPFFT_LIB)/libspfft.a LIBS += $(SPLA_LIB)/libspla.a LIBS += $(HDF5_LIB)/libhdf5.a LIBS += $(LIBVDWXC_LIB)/libvdwxc.a endif endif ifneq ($(USE_COSMA),) USE_COSMA := $(strip $(USE_COSMA)) COSMA_INC := $(INSTALL_PATH)/COSMA-$(USE_COSMA)/include COSMA_LIB := $(INSTALL_PATH)/COSMA-$(USE_COSMA)/lib CFLAGS += -I$(COSMA_INC) DFLAGS += -D__COSMA ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(COSMA_LIB) -L$(COSMA_LIB) -lcosma_prefixed_pxgemm -lcosma -lcosta_prefixed_scalapack -lcosta else LIBS += $(COSMA_LIB)/libcosma_prefixed_pxgemm.a LIBS += $(COSMA_LIB)/libcosma.a LIBS += $(COSMA_LIB)/libcosta_prefixed_scalapack.a LIBS += $(COSMA_LIB)/libcosta.a endif endif ifneq ($(USE_FFTW),) USE_FFTW := $(strip $(USE_FFTW)) FFTW_INC := $(INSTALL_PATH)/fftw-$(USE_FFTW)/include FFTW_LIB := $(INSTALL_PATH)/fftw-$(USE_FFTW)/lib CFLAGS += -I$(FFTW_INC) DFLAGS += -D__FFTW3 ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(FFTW_LIB) -L$(FFTW_LIB) -lfftw3_mpi -lfftw3_omp -lfftw3 else LIBS += $(FFTW_LIB)/libfftw3_mpi.a LIBS += $(FFTW_LIB)/libfftw3_omp.a LIBS += $(FFTW_LIB)/libfftw3.a endif endif ifneq ($(USE_SCALAPACK),) SCALAPACK_LIB := $(INSTALL_PATH)/scalapack-$(USE_SCALAPACK)/lib ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(SCALAPACK_LIB) -L$(SCALAPACK_LIB) -lscalapack else LIBS += $(SCALAPACK_LIB)/libscalapack.a endif endif ifneq ($(USE_GSL),) USE_GSL := $(strip $(USE_GSL)) GSL_INC := $(INSTALL_PATH)/gsl-$(USE_GSL)/include GSL_LIB := $(INSTALL_PATH)/gsl-$(USE_GSL)/lib CFLAGS += -I$(GSL_INC) DFLAGS += -D__GSL ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(GSL_LIB) -L$(GSL_LIB) -lgsl -lgslcblas else LIBS += $(GSL_LIB)/libgsl.a LIBS += $(GSL_LIB)/libgslcblas.a endif endif ifneq ($(USE_OPENBLAS),) USE_OPENBLAS := $(strip $(USE_OPENBLAS)) OPENBLAS_INC := $(INSTALL_PATH)/openblas-$(USE_OPENBLAS)/include OPENBLAS_LIB := $(INSTALL_PATH)/openblas-$(USE_OPENBLAS)/lib CFLAGS += -I$(OPENBLAS_INC) ifeq ($(SHARED), yes) LIBS += -Wl,-rpath=$(OPENBLAS_LIB) -L$(OPENBLAS_LIB) -lopenblas else LIBS += $(OPENBLAS_LIB)/libopenblas.a endif endif CFLAGS += $(DFLAGS) FCFLAGS := $(CFLAGS) $(FCFLAGS_DEBUG) $(WFLAGS) ifeq ($(shell [ $(shell gcc -dumpversion | cut -d. -f1) -gt 9 ] && echo yes), yes) FCFLAGS += -fallow-argument-mismatch endif FCFLAGS += -fbacktrace FCFLAGS += -ffree-form FCFLAGS += -ffree-line-length-none FCFLAGS += -fno-omit-frame-pointer FCFLAGS += -std=f2008 LDFLAGS += $(FCFLAGS) LIBS += -lz -ldl -lstdc++ # End ----------------------------- Build tools ------------------------------ Discovering programs ... =========== FC (psmp) =========== mpif90 --version GNU Fortran (GCC) 11.2.0 Copyright (C) 2021 Free Software Foundation, Inc. This is free software; see the source for copying conditions. There is NO warranty; not even for MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. =========== CC (psmp) =========== mpicc --version gcc (GCC) 11.2.0 Copyright (C) 2021 Free Software Foundation, Inc. This is free software; see the source for copying conditions. There is NO warranty; not even for MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. =========== AR (psmp) =========== ar V GNU ar (GNU Binutils) 2.37 Copyright (C) 2021 Free Software Foundation, Inc. This program is free software; you may redistribute it under the terms of the GNU General Public License version 3 or (at your option) any later version. This program has absolutely no warranty. ========== Make (psmp) ========== make --version GNU Make 3.82 Built for x86_64-redhat-linux-gnu Copyright (C) 2010 Free Software Foundation, Inc. License GPLv3+: GNU GPL version 3 or later This is free software: you are free to change and redistribute it. There is NO WARRANTY, to the extent permitted by law. ========= Python (psmp) ========= /usr/bin/env python3 --version Python 3.6.8 -------------------------- External modules ---------------------------- Discovering programs ... DBCSR Version: 2.2.0 (2021-12-23) ------------------------------- Modules -------------------------------- Currently Loaded Modulefiles: 1) binutils/2.37 3) git/2.30.0 5) gcc/9.3.0 2) TclTk/8.6.9 4) cmake/3.20.5 -------------------------- Leak suppressions --------------------------- # Leak suppressions # known leak either related to mpi or scalapack (e.g. showing randomly for Fist/regtest-7-2/UO2-2x2x2-genpot_units.inp) leak:__cp_fm_types_MOD_cp_fm_write_unformatted # leak related to mpi or scalapack triggers sometimes for regtest-kp-2/cc2.inp leak:Cblacs_gridmap leak:blacs_gridmap_ # leaks related to PEXSI leak:PPEXSIDFTDriver # leaks in SuperLU leak:symbfact_distributeMatrix # leak due to compiler bug triggered by combination of OOP and ALLOCATABLE leak:__dbcsr_tensor_types_MOD___copy_dbcsr_tensor_types_Dbcsr_tas_dist_t leak:__dbcsr_tensor_types_MOD___copy_dbcsr_tensor_types_Dbcsr_tas_blk_size_t # MPICH 3.3.2 with GCC 10.3.0 leak:MPIR_Find_local_and_external leak:MPIU_Find_local_and_external # leaks related to SCALAPACK leak:pdpotrf_ # leaks related to ELPA leak:cublasXtDeviceSelect # leaks related to PEXSI using GNU 10.3.0 and MPICH 3.3.2 on Merlin leak:MPIR_Dataloop_alloc_and_copy leak:MPIR_Type_contiguous_impl ------------------------------ Make CP2K ------------------------------- make -j 56 ARCH=Linux-gnu-x86_64 VERSION=psmp DO_CHECKS=yes distclean >/shared-scratch/krack/rt/Linux-gnu-x86_64/latest-mpich-psmp/make.out 2>&1 make -j 56 ARCH=Linux-gnu-x86_64 VERSION=psmp DO_CHECKS=yes >>/shared-scratch/krack/rt/Linux-gnu-x86_64/latest-mpich-psmp/make.out 2>&1 ERROR: make -j 56 ARCH=Linux-gnu-x86_64 VERSION=psmp DO_CHECKS=yes failed ----------------------------- Make output ------------------------------ Discovering programs ... rm -rf /data/user/krack/rt/gnu-latest-mpich/cp2k/obj/precommit rm -rf /data/user/krack/rt/gnu-latest-mpich/cp2k/obj/prettified rm -rf /data/user/krack/rt/gnu-latest-mpich/cp2k/obj/doxified rm -rf /data/user/krack/rt/gnu-latest-mpich/cp2k/regtesting/Linux-gnu-x86_64/psmp/TEST-* rm -rf /data/user/krack/rt/gnu-latest-mpich/cp2k/regtesting/Linux-gnu-x86_64/psmp/LAST-* rm -rf /data/user/krack/rt/gnu-latest-mpich/cp2k/exe /data/user/krack/rt/gnu-latest-mpich/cp2k/obj /data/user/krack/rt/gnu-latest-mpich/cp2k/lib /data/user/krack/rt/gnu-latest-mpich/cp2k/regtesting Discovering programs ... make -C /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr -f /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/build_dbcsr/Makefile \ ARCHFILE=/data/user/krack/rt/gnu-latest-mpich/cp2k/arch/Linux-gnu-x86_64.psmp \ LIBDIR=/data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/exts/dbcsr \ OBJDIR=/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr \ USE_ACCEL="" \ ACC="" \ ACCFLAGS="" Removing stale archives for psmp ... Resolving dependencies for psmp ... Removing stale archives ... Resolving dependencies ... /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/base/dbcsr_kinds.F dbcsr_kinds.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/dbcsr_btree.F dbcsr_btree.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/hip/dbcsr_hip_profiling.F dbcsr_hip_profiling.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_types.F dbcsr_mm_types.F90 mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/opencl/acc_opencl.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/opencl/acc_opencl_mem.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/opencl/acc_opencl_event.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/opencl/acc_opencl_stream.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/opencl/smm/opencl_libsmm.c mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_kinds.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/base/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_kinds.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_hip_profiling.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/hip/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_hip_profiling.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_btree.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_btree.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_timings_base_type.F dbcsr_timings_base_type.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/base/dbcsr_machine_internal.F dbcsr_machine_internal.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/dbcsr_array_sort.F dbcsr_array_sort.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/dbcsr_string_utilities.F dbcsr_string_utilities.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_timings_base_type.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_timings_base_type.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_string_utilities.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_string_utilities.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_machine_internal.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/base/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_machine_internal.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_array_sort.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_array_sort.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/base/dbcsr_machine.F dbcsr_machine.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_machine.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/base/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_machine.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/base/dbcsr_base_hooks.F dbcsr_base_hooks.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_base_hooks.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/base/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_base_hooks.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_list_callstackentry.F dbcsr_list_callstackentry.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_array_types.F dbcsr_array_types.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/dbcsr_acc_stream.F dbcsr_acc_stream.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F dbcsr_mpiwrap.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_dict.F dbcsr_dict.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_list_routinestat.F dbcsr_list_routinestat.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_list_routinereport.F dbcsr_list_routinereport.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/dbcsr_toollib.F dbcsr_toollib.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/dbcsr_files.F dbcsr_files.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/cuda/dbcsr_cuda_profiling.F dbcsr_cuda_profiling.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_print_messages.F dbcsr_print_messages.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_iter_types.F dbcsr_iter_types.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/dbcsr_acc_device.F dbcsr_acc_device.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/dbcsr_min_heap.F dbcsr_min_heap.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/dbcsr_acc_init.F dbcsr_acc_init.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/dbcsr_acc_timings.F dbcsr_acc_timings.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_allocate_wrap.F dbcsr_allocate_wrap.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_list_callstackentry.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_list_callstackentry.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_array_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_array_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_toollib.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_toollib.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_list_routinereport.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_list_routinereport.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_files.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_files.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_list_routinestat.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_list_routinestat.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_iter_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_iter_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_acc_timings.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_acc_timings.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_cuda_profiling.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/cuda/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_cuda_profiling.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_min_heap.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_min_heap.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_acc_device.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_acc_device.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_acc_stream.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_acc_stream.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_acc_init.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_acc_init.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_allocate_wrap.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_allocate_wrap.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_print_messages.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_print_messages.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_dict.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_dict.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mpiwrap.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mpiwrap.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_global.F dbcsr_tas_global.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_global.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_global.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/dbcsr_acc_event.F dbcsr_acc_event.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/dbcsr_acc_devmem.F dbcsr_acc_devmem.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/dbcsr_acc_hostmem.F dbcsr_acc_hostmem.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_acc_event.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_acc_event.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_acc_devmem.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_acc_devmem.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_acc_hostmem.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/acc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_acc_hostmem.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_timings_types.F dbcsr_timings_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_timings_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_timings_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5392:47: 5392 | CALL MPI_FILE_READ_AT_ALL(fh, offset, msg, msg_len, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 ...... 5414 | CALL MPI_FILE_READ_AT_ALL(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5337:48: 5337 | CALL MPI_FILE_WRITE_AT_ALL(fh, offset, msg, msg_len, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 ...... 5359 | CALL MPI_FILE_WRITE_AT_ALL(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5285:44: 5285 | CALL MPI_FILE_WRITE_AT(fh, offset, msg, msg_len, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 ...... 5307 | CALL MPI_FILE_WRITE_AT(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5050:29: 5048 | CALL mpi_win_create(base(1), len, ${bytes1}$, MPI_INFO_NULL, comm, win, ierr) | 2 5049 | ELSE 5050 | CALL mpi_win_create(foo, len, ${bytes1}$, MPI_INFO_NULL, comm, win, ierr) | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5006:24: 5003 | CALL mpi_irecv(msgout(1, 1), msglen, ${mpi_type1}$, source, my_tag, & | 2 ...... 5006 | CALL mpi_irecv(foo, msglen, ${mpi_type1}$, source, my_tag, & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4954:24: 4954 | CALL mpi_irecv(foo, msglen, ${mpi_type1}$, source, my_tag, & | 1 ...... 5003 | CALL mpi_irecv(msgout(1, 1), msglen, ${mpi_type1}$, source, my_tag, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4903:24: 4900 | CALL mpi_isend(msgin(1, 1), msglen, ${mpi_type1}$, dest, my_tag, & | 2 ...... 4903 | CALL mpi_isend(foo, msglen, ${mpi_type1}$, dest, my_tag, & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4850:24: 4850 | CALL mpi_isend(foo, msglen, ${mpi_type1}$, dest, my_tag, & | 1 ...... 4900 | CALL mpi_isend(msgin(1, 1), msglen, ${mpi_type1}$, dest, my_tag, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4059:26: 4059 | CALL MPI_IALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 ...... 4433 | CALL MPI_IALLGATHER(msgout, scount, ${mpi_type1}$, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4016:25: 4016 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 ...... 4213 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3975:25: 3975 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 ...... 4213 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3811:22: 3811 | CALL mpi_gather(msg, msglen, ${mpi_type1}$, msg_gather, & | 1 ...... 3883 | CALL mpi_gather(msg, msglen, ${mpi_type1}$, msg_gather, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3671:58: 3671 | CALL mpi_iscatter(msg_scatter, msglen, ${mpi_type1}$, msg, & | 1 ...... 3716 | CALL mpi_iscatter(msg_scatter, msglen, ${mpi_type1}$, msg, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3607:39: 3607 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_MIN, gid, ierr) | 1 ...... 3637 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3547:39: 3547 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_MAX, gid, ierr) | 1 ...... 3637 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3363:42: 3363 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_SUM, gid, ierr) | 1 ...... 3637 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-4) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3334:42: 3334 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_SUM, gid, ierr) | 1 ...... 3637 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-3) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3222:42: 3222 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_SUM, gid, ierr) | 1 ...... 3637 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3035:22: 3035 | CALL mpi_ibcast(msg, msglen, ${mpi_type1}$, source, gid, request, ierr) | 1 ...... 3100 | CALL mpi_ibcast(msg, msglen, ${mpi_type1}$, source, gid, request, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3001:21: 3001 | CALL mpi_bcast(msg, msglen, ${mpi_type1}$, source, gid, ierr) | 1 ...... 3161 | CALL mpi_bcast(msg, msglen, ${mpi_type1}$, source, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:2924:20: 2924 | CALL mpi_recv(msg, msglen, ${mpi_type1}$, source, tag, gid, status, ierr) | 1 ...... 2963 | CALL mpi_recv(msg, msglen, ${mpi_type1}$, source, tag, gid, status, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:2852:20: 2852 | CALL mpi_send(msg, msglen, ${mpi_type1}$, dest, tag, gid, ierr) | 1 ...... 2883 | CALL mpi_send(msg, msglen, ${mpi_type1}$, dest, tag, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5497:24-24: 5497 | CALL MPI_FREE_MEM(DATA, mp_res) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5441:27-27: 5441 | CALL MPI_Get_address(ptr, type_descriptor%base, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5414:44-44: 5414 | CALL MPI_FILE_READ_AT_ALL(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5359:45-45: 5359 | CALL MPI_FILE_WRITE_AT_ALL(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5307:41-41: 5307 | CALL MPI_FILE_WRITE_AT(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5120:26-26: 5120 | CALL mpi_rget(base(1), origin_len, handle_origin_datatype, source, disp_aint, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5048:29-29: 5048 | CALL mpi_win_create(base(1), len, ${bytes1}$, MPI_INFO_NULL, comm, win, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:5003:24-24: 5003 | CALL mpi_irecv(msgout(1, 1), msglen, ${mpi_type1}$, source, my_tag, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4900:24-24: 4900 | CALL mpi_isend(msgin(1, 1), msglen, ${mpi_type1}$, dest, my_tag, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4674:24-24: 4674 | CALL mpi_sendrecv(msgin, msglen_in, ${mpi_type1}$, dest, send_tag, msgout, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4639:27-27: 4639 | CALL MPI_IALLGATHERV(msgout, scount, ${mpi_type1}$, msgin, rcount, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4492:26-26: 4492 | CALL MPI_ALLGATHERV(msgout, scount, ${mpi_type1}$, msgin, rcount, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4433:26-26: 4433 | CALL MPI_IALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:4213:25-25: 4213 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3930:23-23: 3930 | CALL mpi_gatherv(sendbuf, sendcount, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3883:22-22: 3883 | CALL mpi_gather(msg, msglen, ${mpi_type1}$, msg_gather, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3761:25-25: 3761 | CALL mpi_iscatterv(msg_scatter, sendcounts, displs, ${mpi_type1}$, msg, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3716:24-24: 3716 | CALL mpi_iscatter(msg_scatter, msglen, ${mpi_type1}$, msg, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3637:39-39: 3637 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3487:23-23: 3487 | CALL mpi_scan(msg, res, msglen, ${mpi_type1}$, MPI_SUM, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3447:25-25: 3447 | CALL mpi_reduce(msg, res, msglen, ${mpi_type1}$, MPI_SUM, root, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3256:43-43: 3256 | CALL mpi_iallreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_SUM, gid, request, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3161:21-21: 3161 | CALL mpi_bcast(msg, msglen, ${mpi_type1}$, source, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:3100:22-22: 3100 | CALL mpi_ibcast(msg, msglen, ${mpi_type1}$, source, gid, request, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:2963:20-20: 2963 | CALL mpi_recv(msg, msglen, ${mpi_type1}$, source, tag, gid, status, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:2883:20-20: 2883 | CALL mpi_send(msg, msglen, ${mpi_type1}$, dest, tag, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:2814:24-24: 2814 | CALL mpi_alltoall(sb, count, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:2691:25-25: 2691 | CALL mpi_alltoallv(sb, scount, sdispl, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mpiwrap.F:1994:25: 1994 | CALL mpi_allreduce(msg, res, msglen/2, MPI_2DOUBLE_PRECISION, MPI_MAXLOC, gid, ierr) | 1 ...... 3637 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/INTEGER(4)). /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/dbcsr_data_types.F dbcsr_data_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_data_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_data_types.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_list_timerenv.F dbcsr_list_timerenv.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_list_timerenv.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_list_timerenv.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_types.F dbcsr_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_types.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_list.F dbcsr_list.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_list.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_list.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/dbcsr_blas_operations.F dbcsr_blas_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_types.F dbcsr_tas_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_blas_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/utils/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_blas_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_types.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_timings.F dbcsr_timings.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_timings.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_timings.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor_index.F dbcsr_tensor_index.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor_index.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor_index.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/dbcsr_ptr_util.F dbcsr_ptr_util.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_timings_report.F dbcsr_timings_report.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_timings_report.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_timings_report.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_ptr_util.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_ptr_util.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_array_list_methods.F dbcsr_array_list_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_array_list_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_array_list_methods.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/dbcsr_data_methods_low.F dbcsr_data_methods_low.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_config.F dbcsr_config.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_config.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_config.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_data_methods_low.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_data_methods_low.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_acc_operations.F dbcsr_acc_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_acc_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_acc_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/dbcsr_mem_methods.F dbcsr_mem_methods.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/block/dbcsr_block_operations.F dbcsr_block_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mem_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mem_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_block_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/block/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_block_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/dbcsr_data_methods.F dbcsr_data_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_data_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_data_methods.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_methods.F dbcsr_methods.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_hostdrv.F dbcsr_mm_hostdrv.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_hostdrv.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_hostdrv.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_log_handling.F dbcsr_log_handling.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mp_methods.F dbcsr_mp_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mp_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mp_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_log_handling.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_log_handling.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_error_handling.F dbcsr_error_handling.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/dist/dbcsr_dist_methods.F dbcsr_dist_methods.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/dbcsr_mp_operations.F dbcsr_mp_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_error_handling.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_error_handling.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_dist_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/dist/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_dist_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mp_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mpi/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mp_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/dist/dbcsr_dist_util.F dbcsr_dist_util.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/block/dbcsr_iterator_operations.F dbcsr_iterator_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/dist/dbcsr_dist_operations.F dbcsr_dist_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_dist_util.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/dist/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_dist_util.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_dist_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/dist/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_dist_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_iterator_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/block/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_iterator_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_accdrv.F dbcsr_mm_accdrv.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_accdrv.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_accdrv.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/block/dbcsr_index_operations.F dbcsr_index_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_dist_operations.F dbcsr_mm_dist_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_dist_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_dist_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_index_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/block/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_index_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/dbcsr_data_operations.F dbcsr_data_operations.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_data_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/data/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_data_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_sched.F dbcsr_mm_sched.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_sched.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_sched.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_csr.F dbcsr_mm_csr.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_csr.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_csr.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/work/dbcsr_work_operations.F dbcsr_work_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_util.F dbcsr_tas_util.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_util.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_util.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_work_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/work/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_work_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_multrec.F dbcsr_mm_multrec.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_multrec.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_multrec.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_split.F dbcsr_tas_split.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_split.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_split.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/block/dbcsr_block_access.F dbcsr_block_access.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_common.F dbcsr_mm_common.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_common.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_common.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_block_access.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/block/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_block_access.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_3d.F dbcsr_mm_3d.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_3d.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_3d.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/dbcsr_operations.F dbcsr_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/dbcsr_test_methods.F dbcsr_test_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_test_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_test_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_operations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_operations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/dbcsr_transformations.F dbcsr_transformations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_base.F dbcsr_tas_base.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_base.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_base.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_transformations.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_transformations.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_io.F dbcsr_tas_io.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_reshape_ops.F dbcsr_tas_reshape_ops.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_io.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_io.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_reshape_ops.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_reshape_ops.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/dbcsr_io.F dbcsr_io.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/dbcsr_csr_conversions.F dbcsr_csr_conversions.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_io.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_io.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_csr_conversions.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_csr_conversions.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm_cannon.F dbcsr_mm_cannon.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm_cannon.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm_cannon.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_mm.F dbcsr_mm.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_mm.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_mm.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/dbcsr_lib.F dbcsr_lib.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/dbcsr_multiply_api.F dbcsr_multiply_api.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_multiply_api.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/mm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_multiply_api.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_lib.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/core/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_lib.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/dbcsr_tests.F dbcsr_tests.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_mm.F dbcsr_tas_mm.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tests.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/ops/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tests.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_mm.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_mm.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/dbcsr_api.F dbcsr_api.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_api.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_api.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/dbcsr_tas_test.F dbcsr_tas_test.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tas_test.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tas/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tas_test.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor_types.F dbcsr_tensor_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor_types.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor_block.F dbcsr_tensor_block.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor_block.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor_block.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor_reshape.F dbcsr_tensor_reshape.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor_split.F dbcsr_tensor_split.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor_io.F dbcsr_tensor_io.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor_reshape.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor_reshape.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor_io.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor_io.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor_split.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor_split.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor.F dbcsr_tensor.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor_test.F dbcsr_tensor_test.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor_test.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor_test.F90 /usr/bin/env python3 /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/tools/build_utils/fypp/bin/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/dbcsr_tensor_api.F dbcsr_tensor_api.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__SHORT_FILE__="\"dbcsr_tensor_api.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src/tensors/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/exts/dbcsr/src' dbcsr_tensor_api.F90 Updating archive /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/exts/dbcsr/libdbcsr.a ar: creating /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/exts/dbcsr/libdbcsr.a /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/base/kinds.F kinds.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/cp_para_types.F cp_para_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/kahan_sum.F kahan_sum.F90 mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/offload/offload_buffer.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/offload/offload_library.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/base/machine_cpuid.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbm/dbm_miniapp.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbm/dbm_matrix.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbm/dbm_shard.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbm/dbm_multiply.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include 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-I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include 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-I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include 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-I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include 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-I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbm/dbm_library.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include 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-I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include 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/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/fft_plan.F fft_plan.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/fft_kinds.F fft_kinds.F90 mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/grid_replay.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/grid_task_list.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/non_orthorombic_corrections.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/grid_collocate_dgemm.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/grid_context_cpu.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/tensor_local.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/grid_prepare_pab_dgemm.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/utils.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/coefficients.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/grid_integrate_dgemm.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/cpu/collocation_integration.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/ref/grid_ref_task_list.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/ref/grid_ref_integrate.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/ref/grid_ref_collocate.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/ref/grid_ref_prepare_pab.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/common/grid_basis_set.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/common/grid_library.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/common/grid_sphere_cache.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fpga/fft_fpga.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fpga/opencl_utils.c mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/grid/grid_unittest.c mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"base/kinds.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/base/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' kinds.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/motion/dumpdcd.F dumpdcd.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/cp_para_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_para_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/xc/xc_input_constants.F xc_input_constants.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/kahan_sum.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' kahan_sum.F90 echo git:76175a8 > "/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/git-ref.tmp" /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/shg_int/constants_operator.F constants_operator.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/fft/fft_plan.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' fft_plan.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/fft/fft_kinds.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' fft_kinds.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pilaenv_hack.F pilaenv_hack.F90 mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/sockets.c /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/motion/xyz2dcd.F xyz2dcd.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"motion/dumpdcd.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/motion/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' dumpdcd.F90 mpicc -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL /data/user/krack/rt/gnu-latest-mpich/cp2k/src/start/libcp2k_unittest.c mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"xc/xc_input_constants.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/xc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' xc_input_constants.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"shg_int/constants_operator.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/shg_int/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' constants_operator.F90 cmp: /data/user/krack/rt/gnu-latest-mpich/cp2k/obj/git-ref: No such file or directory mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pilaenv_hack.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' pilaenv_hack.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"motion/xyz2dcd.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/motion/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' xyz2dcd.F90 Updating archive /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kfpga.a ar: creating /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kfpga.a Updating archive /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kgridcommon.a ar: creating /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kgridcommon.a /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/base/machine.F machine.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/timings_base_type.F timings_base_type.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/string_utilities.F string_utilities.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/lapack.F lapack.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/mathconstants.F mathconstants.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/input_constants.F input_constants.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/minimax/minimax_exp_k53.F minimax_exp_k53.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/arnoldi/arnoldi_types.F arnoldi_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"base/machine.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/base/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' machine.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/timings_base_type.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' timings_base_type.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/arnoldi/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' arnoldi_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/mathconstants.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mathconstants.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"input_constants.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' input_constants.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/string_utilities.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' string_utilities.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/lapack.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' lapack.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"minimax/minimax_exp_k53.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/minimax/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' minimax_exp_k53.F90 Updating archive /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kgridcpu.a ar: creating /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kgridcpu.a /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/physcon.F physcon.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fast.F fast.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/physcon.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' physcon.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/fast.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' fast.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/base/base_hooks.F base_hooks.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"base/base_hooks.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/base/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' base_hooks.F90 Updating archive /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kgridref.a ar: creating /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kgridref.a /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/memory_utilities.F memory_utilities.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/list_routinestat.F list_routinestat.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/routine_map.F routine_map.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/list_callstackentry.F list_callstackentry.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/callgraph.F callgraph.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/cp_min_heap.F cp_min_heap.F90 Updating archive /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kbase.a /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/offload/offload_api.F offload_api.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/list_routinereport.F list_routinereport.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/cp_array_sort.F cp_array_sort.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/cp_files.F cp_files.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.F message_passing.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/cp_iter_types.F cp_iter_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/linear_systems.F linear_systems.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/bessel_lib.F bessel_lib.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/cp_result_types.F cp_result_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/lebedev.F lebedev.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/fparser.F fparser.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/spherical_harmonics.F spherical_harmonics.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/print_messages.F print_messages.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/d3_poly.F d3_poly.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/splines.F splines.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/eigenvalueproblems.F eigenvalueproblems.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/whittaker.F whittaker.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/gamma.F gamma.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/mathlib.F mathlib.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/structure_factor_types.F structure_factor_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/powell.F powell.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/string_table.F string_table.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbt/dbt_allocate_wrap.F dbt_allocate_wrap.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/pw_grid_types.F pw_grid_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/mltfftsg_tools.F mltfftsg_tools.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/atprop_types.F atprop_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/force_field_kind_types.F force_field_kind_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/input/cp_parser_buffer_types.F cp_parser_buffer_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/input/cp_parser_inpp_types.F cp_parser_inpp_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/input/cp_parser_ilist_types.F cp_parser_ilist_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/shell_potential_types.F shell_potential_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/damping_dipole_types.F damping_dipole_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/orbital_pointers.F orbital_pointers.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/orbital_symbols.F orbital_symbols.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/virial_types.F virial_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/fm/cp_blacs_calls.F cp_blacs_calls.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_overlap_debug.F ai_overlap_debug.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_contraction_sphi.F ai_contraction_sphi.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/sto_ng.F sto_ng.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_overlap3_debug.F ai_overlap3_debug.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_contraction.F ai_contraction.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_onecenter.F ai_onecenter.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/ps_wavelet_types.F ps_wavelet_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/ps_wavelet_fft3d.F ps_wavelet_fft3d.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/lazy.F lazy.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/metadyn_tools/graph_utils.F graph_utils.F90 ar: creating /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2kbase.a /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_energy_types.F qs_energy_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/list_routinestat.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' list_routinestat.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/semi_empirical_expns3_types.F semi_empirical_expns3_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/linear_systems.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' linear_systems.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/fparser.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' fparser.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/cp_files.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_files.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/spherical_harmonics.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' spherical_harmonics.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/pw_grid_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' pw_grid_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/mathlib.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mathlib.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/cp_min_heap.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_min_heap.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/list_callstackentry.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' list_callstackentry.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/print_messages.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' print_messages.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"subsys/shell_potential_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' shell_potential_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"input/cp_parser_inpp_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/input/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_parser_inpp_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/whittaker.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' whittaker.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/cp_iter_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_iter_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/cp_result_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_result_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/callgraph.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' callgraph.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"input/cp_parser_ilist_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/input/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_parser_ilist_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/orbital_pointers.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' orbital_pointers.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_contraction.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_contraction.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_energy_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_energy_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/lazy.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' lazy.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"subsys/atprop_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' atprop_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"offload/offload_api.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/offload/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' offload_api.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/splines.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' splines.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"subsys/virial_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' virial_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"subsys/damping_dipole_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' damping_dipole_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/memory_utilities.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' memory_utilities.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/bessel_lib.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' bessel_lib.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/string_table.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' string_table.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"dbt/dbt_allocate_wrap.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbt/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' dbt_allocate_wrap.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_debug.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_overlap_debug.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/routine_map.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' routine_map.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/list_routinereport.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' list_routinereport.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/lebedev.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' lebedev.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/gamma.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' gamma.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/fft/mltfftsg_tools.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mltfftsg_tools.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/cp_array_sort.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_array_sort.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_contraction_sphi.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_contraction_sphi.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/eigenvalueproblems.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' eigenvalueproblems.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_overlap3_debug.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_overlap3_debug.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"fm/cp_blacs_calls.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/fm/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_blacs_calls.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/powell.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' powell.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/structure_factor_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' structure_factor_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"subsys/force_field_kind_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/subsys/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' force_field_kind_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/sto_ng.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' sto_ng.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/ps_wavelet_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ps_wavelet_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/ps_wavelet_fft3d.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ps_wavelet_fft3d.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/d3_poly.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' d3_poly.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_onecenter.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_onecenter.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"input/cp_parser_buffer_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/input/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_parser_buffer_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"semi_empirical_expns3_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' semi_empirical_expns3_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"metadyn_tools/graph_utils.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/metadyn_tools/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' graph_utils.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/orbital_symbols.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' orbital_symbols.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"mpiwrap/message_passing.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' message_passing.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/semi_empirical_mpole_types.F semi_empirical_mpole_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"semi_empirical_mpole_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' semi_empirical_mpole_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/taper_types.F taper_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"taper_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' taper_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/splines_types.F splines_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_dftb_types.F qs_dftb_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/semi_empirical_int_arrays.F semi_empirical_int_arrays.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qmmm_gaussian_types.F qmmm_gaussian_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/eri_mme/eri_mme_util.F eri_mme_util.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/minimax/minimax_exp_k15.F minimax_exp_k15.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/exclusion_types.F exclusion_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/fist_energy_types.F fist_energy_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_rho_atom_types.F qs_rho_atom_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_fb_trial_fns_types.F qs_fb_trial_fns_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/xc/xc_derivative_desc.F xc_derivative_desc.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/xc/xc_rho_cflags_types.F xc_rho_cflags_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/integration_grid_types.F integration_grid_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/block_p_types.F block_p_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mscfg_types.F mscfg_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_dftb_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_dftb_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"splines_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' splines_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/transport_env_types.F transport_env_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_charges_types.F qs_charges_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"semi_empirical_int_arrays.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' semi_empirical_int_arrays.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/wannier_states_types.F wannier_states_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pexsi_interface.F pexsi_interface.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/hfx_helpers.F hfx_helpers.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qmmm_ff_fist.F qmmm_ff_fist.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/hfxbase/hfx_compression_core_methods.F hfx_compression_core_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qmmm_gaussian_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qmmm_gaussian_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/domain_submatrix_types.F domain_submatrix_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mixed_energy_types.F mixed_energy_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/arnoldi/arnoldi_geev.F arnoldi_geev.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"eri_mme/eri_mme_util.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/eri_mme/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' eri_mme_util.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"xc/xc_rho_cflags_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/xc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' xc_rho_cflags_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"exclusion_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' exclusion_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"mscfg_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mscfg_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"xc/xc_derivative_desc.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/xc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' xc_derivative_desc.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"fist_energy_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' fist_energy_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/hfxbase/hfx_contraction_methods.F hfx_contraction_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_fb_trial_fns_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_fb_trial_fns_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"integration_grid_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' integration_grid_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"block_p_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' block_p_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/fermi_utils.F fermi_utils.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"minimax/minimax_exp_k15.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/minimax/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' minimax_exp_k15.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/xc/xc_functionals_utilities.F xc_functionals_utilities.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_hash_table_functions.F qs_hash_table_functions.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_charges_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_charges_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/hfxbase/hfx_contract_block.F hfx_contract_block.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"wannier_states_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' wannier_states_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"hfx_helpers.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' hfx_helpers.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qmmm_ff_fist.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qmmm_ff_fist.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pexsi_interface.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' pexsi_interface.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_rho_atom_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_rho_atom_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/spglib_f08.F spglib_f08.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"arnoldi/arnoldi_geev.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/arnoldi/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' arnoldi_geev.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"transport_env_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' transport_env_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/uff_vdw_radii_table.F uff_vdw_radii_table.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"mixed_energy_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mixed_energy_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"domain_submatrix_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' domain_submatrix_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/wannier90.F wannier90.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mm_mapping_library.F mm_mapping_library.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:4026:44: 4026 | CALL MPI_FILE_READ_AT_ALL(fh, offset, msg, msg_len, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 ...... 4051 | CALL MPI_FILE_READ_AT_ALL(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3969:40: 3969 | CALL MPI_FILE_READ_AT(fh, offset, msg, msg_len, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 ...... 3994 | CALL MPI_FILE_READ_AT(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3910:45: 3910 | CALL MPI_FILE_WRITE_AT_ALL(fh, offset, msg, msg_len, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 ...... 3935 | CALL MPI_FILE_WRITE_AT_ALL(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3852:41: 3852 | CALL MPI_FILE_WRITE_AT(fh, offset, msg, msg_len, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 ...... 3877 | CALL MPI_FILE_WRITE_AT(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3599:29: 3597 | CALL mpi_win_create(base(1), len, ${bytes1}$, MPI_INFO_NULL, comm, win, ierr) | 2 3598 | ELSE 3599 | CALL mpi_win_create(foo, len, ${bytes1}$, MPI_INFO_NULL, comm, win, ierr) | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3549:24: 3546 | CALL mpi_irecv(msgout(1, 1, 1, 1), msglen, ${mpi_type1}$, source, my_tag, & | 2 ...... 3549 | CALL mpi_irecv(foo, msglen, ${mpi_type1}$, source, my_tag, & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3491:24: 3491 | CALL mpi_irecv(foo, msglen, ${mpi_type1}$, source, my_tag, & | 1 ...... 3546 | CALL mpi_irecv(msgout(1, 1, 1, 1), msglen, ${mpi_type1}$, source, my_tag, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3431:24: 3431 | CALL mpi_irecv(foo, msglen, ${mpi_type1}$, source, my_tag, & | 1 ...... 3546 | CALL mpi_irecv(msgout(1, 1, 1, 1), msglen, ${mpi_type1}$, source, my_tag, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3372:24: 3372 | CALL mpi_irecv(foo, msglen, ${mpi_type1}$, source, my_tag, & | 1 ...... 3546 | CALL mpi_irecv(msgout(1, 1, 1, 1), msglen, ${mpi_type1}$, source, my_tag, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3313:24: 3310 | CALL mpi_isend(msgin(1, 1, 1, 1), msglen, ${mpi_type1}$, dest, my_tag, & | 2 ...... 3313 | CALL mpi_isend(foo, msglen, ${mpi_type1}$, dest, my_tag, & | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3254:24: 3254 | CALL mpi_isend(foo, msglen, ${mpi_type1}$, dest, my_tag, & | 1 ...... 3310 | CALL mpi_isend(msgin(1, 1, 1, 1), msglen, ${mpi_type1}$, dest, my_tag, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3192:24: 3192 | CALL mpi_isend(foo, msglen, ${mpi_type1}$, dest, my_tag, & | 1 ...... 3310 | CALL mpi_isend(msgin(1, 1, 1, 1), msglen, ${mpi_type1}$, dest, my_tag, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3132:24: 3132 | CALL mpi_isend(foo, msglen, ${mpi_type1}$, dest, my_tag, & | 1 ...... 3310 | CALL mpi_isend(msgin(1, 1, 1, 1), msglen, ${mpi_type1}$, dest, my_tag, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2114:26: 2114 | CALL MPI_IALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 ...... 2513 | CALL MPI_IALLGATHER(msgout, scount, ${mpi_type1}$, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2072:25: 2072 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 ...... 2273 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2032:25: 2032 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 ...... 2273 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1805:22: 1805 | CALL mpi_gather(msg, msglen, ${mpi_type1}$, msg_gather, & | 1 ...... 1881 | CALL mpi_gather(msg, msglen, ${mpi_type1}$, msg_gather, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1665:58: 1665 | CALL mpi_iscatter(msg_scatter, msglen, ${mpi_type1}$, msg, & | 1 ...... 1710 | CALL mpi_iscatter(msg_scatter, msglen, ${mpi_type1}$, msg, & | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1566:39: 1566 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_MIN, gid, ierr) | 1 ...... 1596 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1503:39: 1503 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_MAX, gid, ierr) | 1 ...... 1596 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1308:42: 1308 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_SUM, gid, ierr) | 1 ...... 1596 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-4) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1277:42: 1277 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_SUM, gid, ierr) | 1 ...... 1596 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-3) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1159:42: 1159 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_SUM, gid, ierr) | 1 ...... 1596 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:958:22: 958 | CALL mpi_ibcast(msg, msglen, ${mpi_type1}$, source, gid, request, ierr) | 1 ...... 1029 | CALL mpi_ibcast(msg, msglen, ${mpi_type1}$, source, gid, request, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:924:21: 924 | CALL mpi_bcast(msg, msglen, ${mpi_type1}$, source, gid, ierr) | 1 ...... 1096 | CALL mpi_bcast(msg, msglen, ${mpi_type1}$, source, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:757:20: 757 | CALL mpi_recv(msg, msglen, ${mpi_type1}$, source, tag, gid, status, ierr) | 1 ...... 886 | CALL mpi_recv(msg, msglen, ${mpi_type1}$, source, tag, gid, status, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:611:20: 611 | CALL mpi_send(msg, msglen, ${mpi_type1}$, dest, tag, gid, ierr) | 1 ...... 716 | CALL mpi_send(msg, msglen, ${mpi_type1}$, dest, tag, gid, ierr) | 2 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (rank-1 and scalar) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:4150:24-24: 4150 | CALL MPI_FREE_MEM(DATA, mp_res) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:4083:27-27: 4083 | CALL MPI_Get_address(ptr, type_descriptor%base, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:4051:44-44: 4051 | CALL MPI_FILE_READ_AT_ALL(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3994:40-40: 3994 | CALL MPI_FILE_READ_AT(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3935:45-45: 3935 | CALL MPI_FILE_WRITE_AT_ALL(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3877:41-41: 3877 | CALL MPI_FILE_WRITE_AT(fh, offset, msg, 1, ${mpi_type1}$, MPI_STATUS_IGNORE, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3677:26-26: 3677 | CALL mpi_rget(base(1), origin_len, handle_origin_datatype, source, disp_aint, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3597:29-29: 3597 | CALL mpi_win_create(base(1), len, ${bytes1}$, MPI_INFO_NULL, comm, win, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3546:24-24: 3546 | CALL mpi_irecv(msgout(1, 1, 1, 1), msglen, ${mpi_type1}$, source, my_tag, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:3310:24-24: 3310 | CALL mpi_isend(msgin(1, 1, 1, 1), msglen, ${mpi_type1}$, dest, my_tag, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2944:24-24: 2944 | CALL mpi_sendrecv(msgin, msglen_in, ${mpi_type1}$, dest, send_tag, msgout, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2740:30-30: 2740 | CALL MPI_REDUCE_SCATTER(msgout, msgin, rcount, ${mpi_type1}$, MPI_SUM, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2713:27-27: 2713 | CALL MPI_IALLGATHERV(msgout, scount, ${mpi_type1}$, msgin, rcount, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2568:26-26: 2568 | CALL MPI_ALLGATHERV(msgout, scount, ${mpi_type1}$, msgin, rcount, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2513:26-26: 2513 | CALL MPI_IALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:2273:25-25: 2273 | CALL MPI_ALLGATHER(msgout, scount, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1974:24-24: 1974 | CALL mpi_igatherv(sendbuf, sendcount, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1927:23-23: 1927 | CALL mpi_gatherv(sendbuf, sendcount, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1881:22-22: 1881 | CALL mpi_gather(msg, msglen, ${mpi_type1}$, msg_gather, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1755:25-25: 1755 | CALL mpi_iscatterv(msg_scatter, sendcounts, displs, ${mpi_type1}$, msg, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1710:24-24: 1710 | CALL mpi_iscatter(msg_scatter, msglen, ${mpi_type1}$, msg, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1629:23-23: 1629 | CALL mpi_scatter(msg_scatter, msglen, ${mpi_type1}$, msg, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1596:39-39: 1596 | CALL mpi_allreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_PROD, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1439:23-23: 1439 | CALL mpi_scan(msg, res, msglen, ${mpi_type1}$, MPI_SUM, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1398:25-25: 1398 | CALL mpi_reduce(msg, res, msglen, ${mpi_type1}$, MPI_SUM, root, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1195:43-43: 1195 | CALL mpi_iallreduce(MPI_IN_PLACE, msg, msglen, ${mpi_type1}$, MPI_SUM, gid, request, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1096:21-21: 1096 | CALL mpi_bcast(msg, msglen, ${mpi_type1}$, source, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:1029:22-22: 1029 | CALL mpi_ibcast(msg, msglen, ${mpi_type1}$, source, gid, request, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:886:20-20: 886 | CALL mpi_recv(msg, msglen, ${mpi_type1}$, source, tag, gid, status, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:716:20-20: 716 | CALL mpi_send(msg, msglen, ${mpi_type1}$, dest, tag, gid, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:573:24-24: 573 | CALL mpi_alltoall(sb, count, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:224:25-25: 224 | CALL mpi_alltoallv(sb, scount, sdispl, ${mpi_type1}$, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.fypp:119:32-32: 119 | CALL mpi_sendrecv_replace(msg, msglen, ${mpi_type1}$, right, tag, left, & | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (COMPLEX(8)/COMPLEX(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.F:4437:31: 4437 | CALL MPI_ALLREDUCE(buffer1, buffer2, ncount, MPI_DOUBLE_PRECISION, MPI_SUM, comm, ierr) | 1 Warning: Type mismatch between actual argument at (1) and actual argument at (2) (REAL(8)/INTEGER(4)). /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.F:2865:25: 2865 | CALL mpi_allreduce(msg, res, msglen/2, MPI_2INTEGER, MPI_MAXLOC, gid, ierr) | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mpiwrap/message_passing.F:2693:25: 2693 | CALL mpi_allreduce(msg, res, msglen/2, MPI_2INTEGER, MPI_MINLOC, gid, ierr) | 1 Warning: Rank mismatch between actual argument at (1) and actual argument at (2) (scalar and rank-1) /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_fb_buffer_types.F qs_fb_buffer_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"fermi_utils.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' fermi_utils.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/minimax/minimax_exp_gw.F minimax_exp_gw.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_hash_table_functions.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_hash_table_functions.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"xc/xc_functionals_utilities.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/xc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' xc_functionals_utilities.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/minimax/minimax_rpa.F minimax_rpa.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"hfxbase/hfx_compression_core_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/hfxbase/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' hfx_compression_core_methods.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/simpar_types.F simpar_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"spglib_f08.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' spglib_f08.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"uff_vdw_radii_table.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' uff_vdw_radii_table.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"hfxbase/hfx_contract_block.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/hfxbase/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' hfx_contract_block.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"wannier90.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' wannier90.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/beta_gamma_psi.F beta_gamma_psi.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"mm_mapping_library.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mm_mapping_library.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_fb_buffer_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_fb_buffer_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qmmm_gaussian_data.F qmmm_gaussian_data.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/motion/md_ener_types.F md_ener_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"minimax/minimax_exp_gw.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/minimax/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' minimax_exp_gw.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"simpar_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' simpar_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mdctrl_types.F mdctrl_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"minimax/minimax_rpa.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/minimax/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' minimax_rpa.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"beta_gamma_psi.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' beta_gamma_psi.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/negf_integr_utils.F negf_integr_utils.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/negf_alloc_types.F negf_alloc_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/farming_types.F farming_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qmmm_gaussian_data.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qmmm_gaussian_data.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"motion/md_ener_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/motion/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' md_ener_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mao_types.F mao_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"hfxbase/hfx_contraction_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/hfxbase/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' hfx_contraction_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"mdctrl_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mdctrl_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"negf_integr_utils.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' negf_integr_utils.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"negf_alloc_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' negf_alloc_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/tmc/tmc_stati.F tmc_stati.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"farming_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' farming_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"mao_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mao_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/tmc/tmc_tree_types.F tmc_tree_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"tmc/tmc_stati.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/tmc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' tmc_stati.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/tmc/tmc_move_types.F tmc_move_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"tmc/tmc_tree_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/tmc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' tmc_tree_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"tmc/tmc_move_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/tmc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' tmc_move_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/tmc/tmc_utils.F tmc_utils.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"tmc/tmc_utils.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/tmc/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' tmc_utils.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/periodic_table.F periodic_table.F90 Updating archive /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2koffload.a mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/periodic_table.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' periodic_table.F90 ar: creating /data/user/krack/rt/gnu-latest-mpich/cp2k/lib/Linux-gnu-x86_64/psmp/libcp2koffload.a /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/fftw3_lib.F fftw3_lib.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/pw_fpga.F pw_fpga.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/fft/fftw3_lib.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' fftw3_lib.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/pw_fpga.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' pw_fpga.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/input/cp_parser_status_types.F cp_parser_status_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"input/cp_parser_status_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/input/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp_parser_status_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_angmom.F ai_angmom.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_angmom.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_angmom.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_oneelectron.F ai_oneelectron.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_overlap3.F ai_overlap3.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_derivatives.F ai_derivatives.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_fermi_contact.F ai_fermi_contact.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_overlap_aabb.F ai_overlap_aabb.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_oneelectron.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_oneelectron.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_grid_atom.F qs_grid_atom.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_overlap3.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_overlap3.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_derivatives.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_derivatives.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_overlap_aabb.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_overlap_aabb.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/libint_wrapper.F libint_wrapper.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/offload_gemm.F offload_gemm.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/cp2k_info.F cp2k_info.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_fermi_contact.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_fermi_contact.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/shg_int/s_contract_shg.F s_contract_shg.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/shg_int/construct_shg.F construct_shg.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_grid_atom.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_grid_atom.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/molsym.F molsym.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/mol_force.F mol_force.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/optimize_basis_types.F optimize_basis_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/memory_utilities_unittest.F memory_utilities_unittest.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/timings_types.F timings_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/util.F util.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/parallel_rng_types.F parallel_rng_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/structure_factors.F structure_factors.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbt/dbt_index.F dbt_index.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ao_util.F ao_util.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/orbital_transformation_matrices.F orbital_transformation_matrices.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_coulomb.F ai_coulomb.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_os_rr.F ai_os_rr.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"offload_gemm.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' offload_gemm.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_verfc.F ai_verfc.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"libint_wrapper.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' libint_wrapper.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"cp2k_info.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' cp2k_info.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"shg_int/construct_shg.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/shg_int/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' construct_shg.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"shg_int/s_contract_shg.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/shg_int/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' s_contract_shg.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/ai_eri_debug.F ai_eri_debug.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"mol_force.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' mol_force.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"optimize_basis_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' optimize_basis_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/memory_utilities_unittest.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' memory_utilities_unittest.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"molsym.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' molsym.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/parallel_rng_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' parallel_rng_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/timings_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' timings_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/util.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' util.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ao_util.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ao_util.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/ps_wavelet_scaling_function.F ps_wavelet_scaling_function.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"dbt/dbt_index.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/dbt/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' dbt_index.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/orbital_transformation_matrices.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' orbital_transformation_matrices.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"common/structure_factors.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/common/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' structure_factors.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_os_rr.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_os_rr.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_coulomb.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_coulomb.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pair_potential_types.F pair_potential_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_verfc.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_verfc.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"aobasis/ai_eri_debug.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/aobasis/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ai_eri_debug.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/ps_wavelet_scaling_function.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' ps_wavelet_scaling_function.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pair_potential_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' pair_potential_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/fftsg_lib.F fftsg_lib.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/hartree_local_types.F hartree_local_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/qs_fb_hash_table_types.F qs_fb_hash_table_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"pw/fft/fftsg_lib.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/pw/fft/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' fftsg_lib.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"qs_fb_hash_table_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' qs_fb_hash_table_types.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"hartree_local_types.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' hartree_local_types.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/tools/build_utils/fypp -n /data/user/krack/rt/gnu-latest-mpich/cp2k/src/metadyn_tools/graph_methods.F graph_methods.F90 mpif90 -c -O2 -fopenmp -fopenmp-simd -ftree-vectorize -funroll-loops -g -mtune=native -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/elpa -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/elpa-2021.11.002/cpu/include/elpa_openmp-2021.11.002/modules -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/quip-b4336484fb65b0e73211a8f920ae4361c7c353fd/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/pexsi-1.2.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/scotch-6.0.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/superlu_dist-6.1.0/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxc-5.2.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libint-v2.6.0-cp2k-lmax-5/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/spglib-1.16.2/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/libxsmm-1.17/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/sirius-7.3.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/COSMA-2.5.1/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/fftw-3.3.10/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/gsl-2.7/include -I/data/user/krack/rt/gnu-latest-mpich/cp2k/tools/toolchain/install/openblas-0.3.19/include -D__parallel -D__SCALAPACK -D__HAS_IEEE_EXCEPTIONS -D__MPI_VERSION=3 -D__MAX_CONTR=4 -D__CHECK_DIAG -D__PLUMED2 -D__ELPA -D__QUIP -D__LIBPEXSI -D__LIBVORI -D__LIBXC -D__LIBINT -D__SPGLIB -D__LIBXSMM -D__SPFFT -D__SPLA -D__HDF5 -D__LIBVDWXC -D__SIRIUS -D__COSMA -D__FFTW3 -D__GSL -fcheck=bounds,do,recursion,pointer -fcheck=all,no-array-temps -ffpe-trap=invalid,overflow,zero -fimplicit-none -finit-derived -finit-real=snan -finit-integer=-42 -finline-matmul-limit=0 -Werror=aliasing -Werror=ampersand -Werror=c-binding-type -Werror=conversion -Werror=intrinsic-shadow -Werror=intrinsics-std -Werror=line-truncation -Wrealloc-lhs -Werror=tabs -Werror=target-lifetime -Werror=underflow -Werror=unused-but-set-variable -Werror=unused-dummy-argument -Werror=unused-variable -fallow-argument-mismatch -fbacktrace -ffree-form -ffree-line-length-none -fno-omit-frame-pointer -std=f2008 -D__COMPILE_ARCH="\"Linux-gnu-x86_64\"" -D__COMPILE_DATE="\"Tue Mar 8 22:21:37 CET 2022\"" -D__COMPILE_HOST="\"merlin-c-223.psi.ch\"" -D__COMPILE_REVISION="\"git:76175a8\"" -D__DATA_DIR="\"/data/user/krack/rt/gnu-latest-mpich/cp2k/data\"" -D__SHORT_FILE__="\"metadyn_tools/graph_methods.F\"" -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/src/metadyn_tools/' -I'/data/user/krack/rt/gnu-latest-mpich/cp2k/obj/Linux-gnu-x86_64/psmp/exts/dbcsr' graph_methods.F90 /data/user/krack/rt/gnu-latest-mpich/cp2k/src/offload_gemm.F:15:8: 15 | USE spla, ONLY: SPLA_PU_HOST, & | 1 Fatal Error: Cannot open module file ‘spla.mod’ for reading at (1): No such file or directory compilation terminated. make[3]: *** [offload_gemm.o] Error 1 make[3]: *** Waiting for unfinished jobs.... make[2]: *** [all] Error 2 make[1]: *** [psmp] Error 2 make: *** [all] Error 2 ------------------------------------------------------------------------ Summary: Compilation failed Status: FAILED Finished batch job rt-Linux-gnu-x86_64-latest-mpich-psmp with the job id 1433585 (merlin) on cluster merlin6 after 350 seconds at Tue Mar 8 22:25:23 CET 2022