[CP2K-user] [CP2K:16777] How to conda install multi-node CP2K

ASSIDUO Network lenardcarroll27 at gmail.com
Sun Mar 27 16:59:19 UTC 2022


Hi there, I would like to conda install cp2k, but I see that the version 
that gets installed (9.1 or 9.2 I believe) only allows for one node. When I 
then run a computation, the output mentions that I am not getting the full 
potential out of my CPU because I am using a generic compiler (gcc). How 
can I install a multi-node conda version of CP2K? I tried editing the conda 
files and then re-building it, but the re-building fails.

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