CP2K

CP2K 6.1

module purge
Intel Parallel Studio XE 2018_2 unloaded
Intel(R) MPI Library  (2018.2.199) unloaded
[@olympelogin3 ]$ module load cp2k/6.1-toolchain
Intel Parallel Studio XE 2018_2 loaded
Intel(R) MPI Library  (2018.2.199) loaded

THIS IS A CP2K-6.1

module li
Currently Loaded Modulefiles:
  1) intel/18.2           2) intelmpi/18.2        3) gcc/7.3.0            4) cp2k/6.1-toolchain

 

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