Spin-orbit ab initio study of alkyl halide dissociation via electronic curve crossing

Journal of Chemical Physics

Volumn 121, Issue 12, 2004, Pages 5761-5766

  Ajitha, D ^a   Wierzbowska, M ^a   Lindh, R ^a   Malmqvist, P A ^a  

^a LUND UNIVERSITY   (Sweden)

Author keywords

[No Author keywords available]

Indexed keywords

DEGREES OF FREEDOM (MECHANICS); GEOMETRY; HALOGEN COMPOUNDS; HAMILTONIANS; OPTIMIZATION; PERTURBATION TECHNIQUES; PHOTODISSOCIATION; POTENTIAL ENERGY; PROBABILITY;

ALKYL HALIDES; EXCITATION ENERGY; FLUORINATION; METHYL HALIDES; PHOTOFRAGMENT;

MOLECULAR DYNAMICS;

EID: 5544229534     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1784411     Document Type: Article

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