[CP2K-user] parallel runing

AMIT KUMAR 2018r... at mnit.ac.in
Sat Sep 14 07:19:36 UTC 2019


For parallel running, which one is more suitable between cp2k.ssmp and 
cp2k.psmp?
Is the speed of the job linearly dependent on the number of processors? if 
not
then what is the optimum processor for running a BOMD simulation job with a 
system containing around 200 water molecules.

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