[CP2K-user] [CP2K:16776] Cannot use CP2K via Docker/Singularity

ASSIDUO Network lenardcarroll27 at gmail.com
Sun Mar 27 16:57:12 UTC 2022

Hi there, I hope you are doing well. 

I tried using CP2K via Docker following 
this https://hub.docker.com/r/cp2k/cp2k
but I get the following error message:
/opt/cp2k/prod_entrypoint.sh: line 20:   443 Illegal instruction     "$@"

Then when using singularity instead of docker, I get the following error 
ln: failed to create symbolic link '/opt/cp2k/exe/local/cp2k': Read-only 
file system

Can you help me resolve this? I've been trying to get CP2K working for a 
month now at my local HPC. I have failed, so I turned to asking help from 
admin, but they too cannot get it right. So now I am trying to go for a 
container, but I get the above error messages.

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