TDDFT Error with "xc new m06-2x"
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Forum Vet
10:58:58 AM PST - Tue, Dec 11th 2018
Quote:Mdsimulationgroup
Dec 11th 7:11 am
Is it not possible to do TDDFT calculations with M06-2X? Also, does the documentation have anything about the depreciation of NWXC in 6.8? Thank you!
Have a look at the release notes for 6.8
https://github.com/nwchemgit/nwchem/blob/master/release.notes.6.8
* NWXC module excluded from NWCHEM_MODULES=all