6.1.1 MPI build runs great, but only on 1 node

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Forum >> NWChem's corner >> Compiling NWChem >> 6.1.1 MPI build runs great, but only on 1 node

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10:31:13 AM PDT - Wed, Jul 18th 2012
Ooops! My PBS job script was autoformatted when I submitted. It should look like this:

\#!/bin/bash
\#PBS -N nwchem
\#PBS -l select=2:ncpus=8:mpiprocs=8:mem=8gb,walltime=00:30:00
\#PBS -j oe

mpiexec -n 16 nwchem formaldehyde.scf.nwchem > formaldehyde.scf.out


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