BGES-1

FUNCTIONAL NAME: BGES-1


This is an EXCHANGE Density Functional Theory functional


FUNCTIONAL FAMILY: MGGA


The functional is a HYBRID functional


DESCRIPTION: Half-and-half meta-LDAized PW correlation by Lehtola and Marques. Machine Learned Interatomic Potentials




REFERENCES


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

DOI: 10.1021/acs.jctc.0c01147