sample qmd input from nwchem official page does not work


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Jrt2018
I can see that you are using NWChem 6.5 from this output line

/aplic/nwchem/6.5_ompi1.6.5_ifort12.1


Unfortunately, the com_step input option was introduced in NWChem 6.6.

Therefore, the only solution to your problem is to move to a more recent NWChem version (6.8 being the latest so far)