New link between conceptual density functional theory and electron delocalization

Journal of Physical Chemistry A

Volumn 115, Issue 45, 2011, Pages 12459-12462

  Matito, Eduard ^a   Putz, Mihai V ^b  

^a UNIVERSITY OF SZCZECIN   (Poland)

^b WEST UNIVERSITY OF TIMISOARA   (Romania)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL CALCULATIONS; COMPUTATIONAL TOOLS; CONCEPTUAL DENSITY FUNCTIONAL THEORY; DIATOMICS; ELECTRON DELOCALIZATION; ELECTRON FLUCTUATION; ELECTRON LOCALIZATIONS; EXCHANGE-CORRELATION DENSITY; EXTERNAL PERTURBATIONS;

DENSITY FUNCTIONAL THEORY;

EID: 80855150877     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp200731d     Document Type: Article

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