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version_history [2019/08/14 07:04]
vondele [Trunk (7.0, development)]
version_history [2019/08/14 07:05]
vondele [6.1]
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   * Projection-operator adiabatization (POD) method   * Projection-operator adiabatization (POD) method
-  * CP2K can now do Plane Wave ([[inp>​FORCE_EVAL/​PW_DFT]]) ​calculations ​on CPU and GPU based on [[https://​github.com/​electronic-structure/​SIRIUS|SIRIUS]]. See also [[howto:​running_qe_computation | a tutorial]] to create a CP2K+SIRIUS input from a QuantumEspresso example input.+  * CP2K can now do Plane Wave calculations ​using CPU and GPUbased on an electronic structure library ​[[https://​github.com/​electronic-structure/​SIRIUS|SIRIUS]]
   * Include NVIDIA P100 kernels for DBCSR   * Include NVIDIA P100 kernels for DBCSR
   * Update toolchain   * Update toolchain
version_history.txt ยท Last modified: 2019/08/14 07:05 by vondele