Optimization of an exchange-correlation density functional for water

Journal of Chemical Physics

Volumn 144, Issue 22, 2016, Pages

  Fritz, Michelle ^a   Fernández Serra, Marivi ^b   Soler, José M ^c  

^a UNIVERSIDAD AUTÓNOMA DE MADRID   (Spain)

^b STONY BROOK UNIVERSITY   (United States)

^c Ciudad Universitaria de Cantoblanco   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

CARRIER CONCENTRATION; VAN DER WAALS FORCES;

CONDENSED WATER; DATA PROJECTION; ELECTRON EXCHANGE; ENERGY FUNCTIONALS; EXCHANGE-CORRELATION DENSITY; FUNCTIONAL FORMS; GENERALIZED GRADIENT APPROXIMATIONS; PARAMETER SPACES;

DENSITY FUNCTIONAL THEORY;

EID: 84973924482     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4953081     Document Type: Article

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