FUNCTIONAL NAME: WP04-PYSCF
This is an EXCHANGE-CORRELATION Density Functional Theory functional
FUNCTIONAL FAMILY: GGA
The functional is a HYBRID functional
DESCRIPTION: hybrid fitted to proton NMR shifts. PySCF variant.
REFERENCES
K. W. Wiitala, T. R. Hoye, and C. J. Cramer., J. Chem. Theory Comput. 2, 1085-1092 (2006)
DOI: 10.1021/ct6001016