PEO-H3

FUNCTIONAL NAME: PEO-H3


This is a CORRELATION Density Functional Theory functional


FUNCTIONAL FAMILY: MGGA


The functional is a HYBRID functional


DESCRIPTION: revised SCAN. Machine Learned Potential.




REFERENCES


P. D. Mezei, G. I. Csonka, and M. Kállay., J. Chem. Theory Comput. 14, 2469-2479 (2018)

DOI: 10.1021/acs.jctc.8b00072