Multithreading in NWChem


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Gets Around
Yes, you should launch NWChem with mpirun/mpiexec if you want to use more than one core per node. I do not understand your screenshot, because "./nwchem" should not launch multiple processes.

To the topic in the subject, NWChem is threaded in a few modules, such as NWPW, semidirect CCSD(T) and TCE.