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Optimization of mixed quantum-classical dynamics: Time-derivative coupling terms and selected couplings
- 1.0335823 - ÚFCH JH 2010 RIV NL eng J - Journal Article
Pittner, Jiří - Lischka, H. - Barbatti, M.
Optimization of mixed quantum-classical dynamics: Time-derivative coupling terms and selected couplings.
[Optimalizace smíšené kvantově-klasické dynamiky: Vazebné členy z časových derivací a výběr vazebných členů.]
Chemical Physics. Roč. 356, 1-3 (2009), s. 147-152. ISSN 0301-0104. E-ISSN 1873-4421
R&D Projects: GA AV ČR IAA400400810
Institutional research plan: CEZ:AV0Z40400503
Keywords : mixed-quantum classical dynamics * non-adiabatic coupling * molecular dynamics
Subject RIV: CF - Physical ; Theoretical Chemistry
Impact factor: 2.277, year: 2009
Permanent Link: http://hdl.handle.net/11104/0180184
Number of the records: 1