Survival of the most transferable at the top of Jacob’s ladder: Defining and testing the ωB97M(2) double hybrid density functional
Author:
Affiliation:
1. Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California, Berkeley, California 94720, USA
2. Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA
Funder
National Institutes of Health
Basic Energy Sciences
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/am-pdf/10.1063/1.5025226
Reference114 articles.
1. Inhomogeneous Electron Gas
2. Self-Consistent Equations Including Exchange and Correlation Effects
3. Thirty years of density functional theory in computational chemistry: an overview and extensive assessment of 200 density functionals
4. Prescription for the design and selection of density functional approximations: More constraint satisfaction with fewer fits
5. A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions
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