FUNCTIONAL NAME: KPYW-0
This is an EXCHANGE-CORRELATION Density Functional Theory functional
FUNCTIONAL FAMILY: GGA
DESCRIPTION: XLYP MLIP
REFERENCES
X. Xu and W. A. Goddard., Proc. Natl. Acad. Sci. U. S. A. 101, 2673 (2004)
DOI: 10.1073/pnas.0308730100