Saturday, October 2, 2010

SSB-D functional in NWChem 6.0

Last week the latest version of NWChem (6.0) was announced, which contains the SSB-D functional in it.

After the inclusion in ADF, this is now the second main Quantum-Chemistry program that contains SSB-D, with more to follow (Turbomole, Gamess-US?, Orca?, Gaussian?).

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