[CP2K-user] [CP2K:16150] Running cp2k with Docker.cuda

Ray Schireman raymondschireman at gmail.com
Sat Oct 30 21:42:52 UTC 2021


Hi all,

I successfully compiled the cp2k (version 9.0) toolchain with the provided 
Cuda Dockerfile. However, I'm not sure how to compile the cp2k executable 
with this toolchain. I can't seem to find a guide on how to do this, so any 
assistance is appreciated.


Thanks,
Ray 

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