HLTAPW-NWCHEM

FUNCTIONAL NAME: HLTAPW-NWCHEM


This is a CORRELATION Density Functional Theory functional


FUNCTIONAL FAMILY: MGGA


DESCRIPTION: Half-and-half meta-LDAized PW correlation by Lehtola and Marques. NWChem variant.




REFERENCES


S. Lehtola and M. A. L. Marques., J. Chem. Theory Comput. 17, 943-948 (2021)

DOI: 10.1021/acs.jctc.0c01147