On the universality of the long-/short-range separation in multiconfigurational density-functional theory. II. Investigating f0 actinide species

Journal of Chemical Physics

Volumn 131, Issue 5, 2009, Pages

  Fromager, Emmanuel ^a,b   Ŕal, Florent ^c,d   Ẃhlin, Pernilla ^d   Wahlgren, Ulf ^d   Jensen, Hans Jørgen Aa ^e  

^a UNIVERSITÉ DE STRASBOURG   (France)

^b UNIVERSITY OF TROMSØ   (Norway)

^c UNIVERSITÉ DES SCIENCES ET TECHNOLOGIES DE LILLE   (France)

^d ALBANOVA UNIVERSITY CENTER   (Sweden)

^e UNIVERSITY OF SOUTHERN DENMARK   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

ACTINIDE COMPOUND; CORRELATION EFFECT; ELECTRON INTERACTION; EQUILIBRIUM GEOMETRIES; FUNCTIONALS; LIGHT ELEMENTS; MULTICONFIGURATIONAL SELF-CONSISTENT FIELDS; NEPTUNYL; OPTIMAL VALUES; SHORT-RANGE EXCHANGE; STUDY CASE; WAVE FUNCTION THEORY;

CHEMICAL ELEMENTS; COPPER OXIDES; PROBABILITY DENSITY FUNCTION; SEMICONDUCTOR COUNTERS; SEPARATION; TIME VARYING SYSTEMS; WAVE FUNCTIONS;

DENSITY FUNCTIONAL THEORY;

EID: 68949103969     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3187032     Document Type: Article

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