PBETRANS-PYSCF

FUNCTIONAL NAME: PBETRANS-PYSCF


This is an EXCHANGE Density Functional Theory functional


FUNCTIONAL FAMILY: GGA


DESCRIPTION: Gradient-regulated connection-based correction for the PBE exchange. PySCF variant.




REFERENCES


Éric Brémond, I. Ciofini, and C. Adamo., Mol. Phys. 114, 1059-1065 (2016)

DOI: 10.1080/00268976.2015.1132788