The on-the-fly surface-hopping program system Newton-X: Application to ab initio simulation of the nonadiabatic photodynamics of benchmark systems

Journal of Photochemistry and Photobiology A: Chemistry

Volumn 190, Issue 2-3, 2007, Pages 228-240

  Barbatti, Mario ^a   Granucci, Giovanni ^b   Persico, Maurizio ^b   Ruckenbauer, Matthias ^a   Vazdar, Mario ^c   Eckert Maksić, Mirjana ^c   Lischka, Hans ^a  

^a UNIVERSITY OF VIENNA   (Austria)

^b UNIVERSITY OF PISA   (Italy)

^c RUDER BO KOVI INSTITUTE   (Croatia)

Author keywords

Ab initio dynamics; Excited state dynamics; Nonadiabatic phenomena; On the fly surface hopping dynamics; Ultrafast photochemistry

Indexed keywords

EID: 34447622847     PISSN: 10106030     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jphotochem.2006.12.008     Document Type: Article

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