| 7:08:22 AM PDT - Mon, Mar 30th 2020 |
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Hi,
I would execute a ONIOM calculation and I would add to classical part the dispersion contribute as parametrize with D3 grimme.
With Gaussian code this is possible with 'external program'.
Is it possible also with NWCHEM?
Actually I use the vesion 6.8
regards
Marcel
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