R2SCAN01

FUNCTIONAL NAME: R2SCAN01


This is an EXCHANGE Density Functional Theory functional


FUNCTIONAL FAMILY: MGGA


DESCRIPTION: Re-regularized SCAN exchange by Furness et al with larger value for eta




REFERENCES


J. W. Furness, A. D. Kaplan, J. Ning, J. P. Perdew, and J. Sun., J. Phys. Chem. Lett. 11, 8208-8215 (2020)

DOI: 10.1021/acs.jpclett.0c02405


J. W. Furness, A. D. Kaplan, J. Ning, J. P. Perdew, and J. Sun., J. Phys. Chem. Lett. 11, 9248-9248 (2020)

DOI: 10.1021/acs.jpclett.0c03077