Semiclassical frozen Gaussian propagation method for electronically nonadiabatic chemical dynamics: Møller operator formulation and incorporation of the Zhu-Nakamura theory

Journal of Theoretical and Computational Chemistry

Volumn 4, Issue 1, 2005, Pages 89-102

  Kondorskiy, Alexey ^a,b   Nakamura, Hiroki ^a,c  

^a INSTITUTE FOR MOLECULAR SCIENCE   (Japan)

^b LEBEDEV PHYSICAL INSTITUTE   (Russian Federation)

^c GRADUATE UNIVERSITY FOR ADVANCED STUDIES   (Japan)

Author keywords

Herman Kluk theory; Nonadiabatic transitions; Semiclassical dynamics; Semiclassical frozen Gaussian approximation; Zhu Nakamura theory

Indexed keywords

CONFERENCE PAPER; ENERGY; MATHEMATICAL MODEL; MOLECULAR MECHANICS; NORMAL DISTRIBUTION; QUANTUM CHEMISTRY; QUANTUM THEORY; THEORETICAL MODEL;

EID: 17644366435     PISSN: 02196336     EISSN: None     Source Type: Journal    
DOI: 10.1142/S0219633605001404     Document Type: Conference Paper

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