Maps of current density using density-functional methods

Journal of Chemical Physics

Volumn 129, Issue 7, 2008, Pages

  Soncini, A ^a   Teale, A M ^a   Helgaker, T ^a   De Proft, F ^b   Tozer, D J ^c  

^a UNIVERSITY OF OSLO   (Norway)

^b VRIJE UNIVERSITEIT BRUSSEL   (Belgium)

^c DURHAM UNIVERSITY   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

CHLORINE COMPOUNDS; CURRENT DENSITY; DISCRETE FOURIER TRANSFORMS; MAGNETIC FIELDS; MAPS; PROBABILITY DENSITY FUNCTION; WAVE FUNCTIONS;

B3LYP HYBRID FUNCTIONAL; COUPLED-CLUSTER SINGLES; DENSITY-FUNCTIONAL METHODS; ELECTRON DENSITIES; HARTREE-FOCK THEORY; MAGNETIC RESPONSES; OPTIMIZED EFFECTIVE POTENTIAL; SEARCH PROCEDURES; SMALL MOLECULES;

DENSITY FUNCTIONAL THEORY;

EID: 50249128164     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2969104     Document Type: Article

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