BLYP35-PYSCF

FUNCTIONAL NAME: BLYP35-PYSCF


This is an EXCHANGE-CORRELATION Density Functional Theory functional


FUNCTIONAL FAMILY: GGA


The functional is a HYBRID functional


DESCRIPTION: BLYP35. PySCF variant.




REFERENCES


M. Renz, K. Theilacker, C. Lambert, and M. Kaupp., J. Am. Chem. Soc. 131, 16292-16302 (2009)

DOI: 10.1021/ja9070859


M. Kaupp, M. Renz, M. Parthey, M. Stolte, F. Würthner, and C. Lambert., Phys. Chem. Chem. Phys. 13, 16973-16986 (2011)

DOI: 10.1039/C1CP21772K