Charge-transfer complexes: Stringent tests for widely used density functionals

Journal of Physical Chemistry

Volumn 100, Issue 30, 1996, Pages 12265-12276

  Ruiz, Eliseo ^a,b   Salahub, Dennis R ^a   Vela, Alberto ^a,c  

^a UNIVERSITÉ DE MONTRÉAL   (Canada)

^b UNIVERSITY OF BARCELONA   (Spain)

^c DEPARTAMENTO DE QUÍMICA   (Mexico)

Author keywords

[No Author keywords available]

Indexed keywords

AMMONIA; CALCULATIONS; CHARGE TRANSFER; ETHYLENE; HALOGEN COMPOUNDS; MOLECULAR DYNAMICS; PHYSICAL CHEMISTRY;

CHARGE-TRANSFER COMPLEXES; DENSITY FUNCTIONAL CALCULATIONS; EXCHANGE CORRELATION POTENTIALS; INTERMOLECULAR INTERACTIONS;

ORGANIC COMPOUNDS;

EID: 0030197702     PISSN: 00223654     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp9533077     Document Type: Article

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