why nwchem 6.0 crashes in parallel run

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Forum Vet

10:07:04 AM PDT - Wed, Sep 14th 2016
wrong mpirun
You are using a mpirun that is not compatible with the MPI library that was used to compile NWChem. This is clear from the replication of lines in the output file. PS NWChem 6.0 is rather obsolete