High-level electron correlation calculations on formamide and the resonance model

Journal of Physical Chemistry A

Volumn 101, Issue 7, 1997, Pages 1400-1408

  Fogarasi, Géza ^a   Szalay, Péter G ^a  

^a EÖTVÖS LORÁND UNIVERSITY   (Hungary)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL BONDS; CORRELATION METHODS; ELECTRON RESONANCE; ELECTRONS; GEOMETRY; MATHEMATICAL MODELS; OPTIMIZATION; QUANTUM THEORY; ROTATION; SET THEORY; VIBRATIONS (MECHANICAL);

BOND LENGTH; CHARGE SHIFTS; CHEMICAL SHIELDINGS; FORMAMIDE; INTERNAL ROTATION; RELEVANT VALENCE ORBITALS;

ORGANIC COMPOUNDS;

EID: 0031079517     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp963765v     Document Type: Article

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