Non-empirical exchange-correlation parameterizations based on exact conditions from correlated orbital theory
Author:
Affiliation:
1. Quantum Theory Project, University of Florida, Gainesville, Florida 32611-8435, USA
2. São Carlos Institute of Chemistry, University of São Paulo, CP 780, 13560-970 São Carlos, SP, Brazil
Funder
Fundação de Amparo à Pesquisa do Estado de São Paulo
U.S. Air Force
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/am-pdf/10.1063/1.5025723
Reference59 articles.
1. Towards an exact correlated orbital theory for electrons
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5. Ab initio density functional theory applied to quasidegenerate problems
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