Nwchem(any version) and NBO (5.9) linking


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Yes, this post will hold for NWChem 6.1.1. These changes would have to occur in the NBO code, and have to been addressed by the developers.

Bert


Quote:Jwkeller Feb 19th 8:06 pm
Are these changes now included in NWChem 6.1.1 (Jan 2013)?
If not, does Bert's post constitute a recommended addendum to the procedure for linking NWChem 6.1.1 to NBO 5.9?