[CP2K-user] [CP2K:16327] Install on SGE Cluster w CentOS

Sebastian Muraru sebmuraru at gmail.com
Thu Dec 2 12:18:36 UTC 2021


Hi,

I have previously successfully installed cp2k on a workstation (psmp). I am 
now trying to do the same on an SGE cluster with similar machines.

sim_job_output and sim_job_error attached. Also attached script.sh.png , I 
am supposed to know my way around using install_cp2k_toolchain (at least on 
a local workstation), however it seems some script (get_openblas_arch.sh) 
does not download the package it is meant to. 

Screenshot...14-12-38.png shows the point at which I get the error in the 
get_openblas_arch.sh script.

If anyone can help me out, I am grateful.

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