MB88-PYSCF

FUNCTIONAL NAME: MB88-PYSCF


This is an EXCHANGE Density Functional Theory functional


FUNCTIONAL FAMILY: GGA


DESCRIPTION: Modified Becke 88 for proton transfer. PySCF variant.




REFERENCES


V. Tognetti and C. Adamo., J. Phys. Chem. A 113, 14415 (2009)

DOI: 10.1021/jp903672e