Ab initio study of the spectroscopy of Agl: A complete active space self-consistent field+averaged coupled pair functional approach to the lowest excited states

Journal of Chemical Physics

Volumn 118, Issue 1, 2003, Pages 104-112

  Ramirez Solis A ^a  

^a UNIVERSIDAD AUTÓNOMA DEL ESTADO DE MORELOS   (Mexico)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMS; CALCULATIONS; ELECTRONIC STRUCTURE; GROUND STATE; MOLECULAR DYNAMICS; OPTIMIZATION; PERTURBATION TECHNIQUES; SILVER COMPOUNDS;

COUPLED PAIR FUNCTIONAL CALCULATION; EXCITED STATE; GAUSSIAN BASIS SET; SELF-CONSISTENT FIELD; SILVER HALIDE;

MOLECULAR SPECTROSCOPY;

EID: 0037261163     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1524156     Document Type: Article

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