Accurate vibrational spectra and magnetic properties of organic free radicals: The case of H 2CN

Journal of Chemical Physics

Volumn 122, Issue 22, 2005, Pages

  Barone, Vincenzo ^a   Carbonniere, Philippe ^a,b   Pouchan, Claude ^b  

^a UNIVERSITY OF NAPLES FEDERICO II   (Italy)

^b UNIVERSITÉ DE PAU ET DES PAYS DE L'ADOUR   (France)

Author keywords

[No Author keywords available]

Indexed keywords

KOHN SHAM METHODS; SECOND ORDER PERTURBATIVE APPROACH; VIBRATIONAL PROPERTIES; VIBRATIONAL SPECTRA;

APPROXIMATION THEORY; COMPUTATIONAL METHODS; ELECTRON TRANSITIONS; FREE RADICALS; MAGNETIC PROPERTIES; MOLECULAR VIBRATIONS; QUANTUM THEORY;

ORGANIC COMPOUNDS;

EID: 20544475852     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1924592     Document Type: Article

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