howto:compile_on_mac
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| howto:compile_on_mac [2018/04/16 12:08] – gtocci | howto:compile_on_mac [2022/11/20 15:01] – Delete outdated howto krack | ||
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| - | ====== How to Compile CP2K on Mac OS X ====== | ||
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| - | ===== 1.Acquiring the code ===== | ||
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| - | If you don't have it already, you need an X11 server. Download and install [[https:// | ||
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| - | After that, go to the [[https:// | ||
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| - | Using the Mac terminal, go to the directory where cp2k has been downloaded (if it has been downloaded in the '' | ||
| - | To unpack the archive files type the command given below | ||
| - | < | ||
| - | tar -xvf cp2k-2.6.2.tar.bz2 | ||
| - | </ | ||
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| - | ===== 2.Compilation on Mac ===== | ||
| - | An example CP2K ARCH file for a serial build of CP2K on Mac is as follows:\\ | ||
| - | < | ||
| - | # With GCC 4.9 or later, for gcc and gfortran | ||
| - | # libxc is installed in LIBXC_INCLUDE_DIR / LIBXC_LIB_DIR | ||
| - | # libint is installed in LIBINT_LIB_DIR | ||
| - | CC = gcc | ||
| - | CPP = | ||
| - | FC = gfortran | ||
| - | LD = gfortran | ||
| - | AR = ar -r | ||
| - | RANLIB | ||
| - | DFLAGS | ||
| - | FCFLAGS | ||
| - | | ||
| - | LDFLAGS | ||
| - | LIBS = -framework Accelerate | ||
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| - | </ | ||
| - | Remove the -D__LIBXC -D__LIBINT flag if you compile CP2K. Save it as '' | ||
| - | Launch the Terminal and change the working directory to '' | ||
| - | < | ||
| - | make ARCH=Darwin-IntelMacintosh-gfortran VERSION=sopt | ||
| - | </ | ||
| - | It may take quite a while until a compilation is completed. | ||
| - | If you find '' | ||
howto/compile_on_mac.txt · Last modified: 2022/11/20 15:05 by krack