KT3-PSI4

FUNCTIONAL NAME: KT3-PSI4


This is an EXCHANGE-CORRELATION Density Functional Theory functional


FUNCTIONAL FAMILY: GGA


DESCRIPTION: Keal and Tozer, version 3. Psi4 variant.




REFERENCES


T. W. Keal and D. J. Tozer., J. Chem. Phys. 121, 5654-5660 (2004)

DOI: 10.1063/1.1784777