FUNCTIONAL NAME: B3LYPS-NWCHEM
This is an EXCHANGE-CORRELATION Density Functional Theory functional
FUNCTIONAL FAMILY: GGA
The functional is a HYBRID functional
DESCRIPTION: B3LYP*. NWChem variant.
REFERENCES
M. Reiher, O. Salomon, and B. A. Hess., Theor. Chem. Acc. 107, 48-55 (2001)
DOI: 10.1007/s00214-001-0300-3