Alternative separation of exchange and correlation energies in multi-configuration range-separated density-functional theory

Journal of Chemical Physics

Volumn 139, Issue 13, 2013, Pages

  Stoyanova, Alexandrina ^a,b   Teale, Andrew M ^c,d   Toulouse, Julien ^e   Helgaker, Trygve ^d   Fromager, Emmanuel ^a  

^a UNIVERSITÉ DE STRASBOURG   (France)

^b MAX PLANCK INSTITUT FÜR PHYSIK KOMPLEXER SYSTEME   (Germany)

^c UNIVERSITY OF NOTTINGHAM   (United Kingdom)

^d UNIVERSITY OF OSLO   (Norway)

^e SORBONNE UNIVERSITÉ   (France)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; LOCAL DENSITY APPROXIMATION;

ANALYTICAL EXPRESSIONS; ANALYTICAL GRADIENTS; ENERGY EXPRESSION; ENERGY GRADIENTS; EXCHANGE AND CORRELATION; OPTIMIZED EFFECTIVE POTENTIAL; SELF-CONSISTENT FIELD; SHORT-RANGE EXCHANGE;

SEPARATION;

EID: 84903362352     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4822135     Document Type: Article

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