B88B95-PYSCF

FUNCTIONAL NAME: B88B95-PYSCF


This is an EXCHANGE-CORRELATION Density Functional Theory functional


FUNCTIONAL FAMILY: MGGA


The functional is a HYBRID functional


DESCRIPTION: Mixture of B88 with BC95 (B1B95). PySCF variant.




REFERENCES


A. D. Becke., J. Chem. Phys. 104, 1040 (1996)

DOI: 10.1063/1.470829