[molpro-user] Questions about prallel execution
zhendong zhao
zzhao at olemiss.edu
Sat Dec 13 02:25:44 GMT 2008
Dear MolPro users,
I am a new molpro user, and I am a bit of confused with parallel
excuting molpro.
For a multiple-core CPU box, is this a shared-memory system or
distritued memory system? Should I use molpro -n 4 input.com, or molpro
-n 1:4 input.com?
In a parallel calculation, what does the memory specification in the
input file mean? It stands for the total memory requested or memory
requested per core/processor? what is the relation with command line
supplied working memory?
Thanks in advance,
Zhendong
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