Electric and magnetic properties of the four most stable CHNO isomers from ab initio CCSD(T) studies

Journal of Chemical Physics

Volumn 131, Issue 3, 2009, Pages

  Mladenović, Mirjana ^a   Elhiyani, Mohamed ^a   Lewerenz, Marius ^a  

^a Centre National de la Recherche Scientifique   (France)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; CCSD; ELECTRIC FIELD GRADIENTS; ELECTRON DENSITIES; ELECTRONIC STRUCTURE CALCULATIONS; GROUND ELECTRONIC STATE; HYPERFINE STRUCTURE; ISOCYANIC ACIDS; MICROWAVE SPECTRUM; MULLIKEN POPULATION ANALYSIS; THEORETICAL RESULT;

CHEMICAL BONDS; ELECTRIC FIELDS; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; ISOMERS; MAGNETIC PROPERTIES; MICROWAVE SPECTROSCOPY; MOLECULAR ORBITALS; ORGANIC ACIDS;

ELECTRIC PROPERTIES;

EID: 67651162242     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3173275     Document Type: Article

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