| 10:59:58 AM PDT - Tue, Mar 12th 2019 |
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| I would like to determine the irreducible representations of normal modes for Raman analysis of a variety of molecules to large to feasibly calculate the Raman tensor. I do not see that NWChem does this anywhere, am I missing it in the documentation or is there another program that others might suggest after calculating their vibrational spectra with NWChem?
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