A natural decay of mixing algorithm for non-Born–Oppenheimer trajectories
We present a new method called the natural decay of mixing (NDM) method for introducing decoherence effects into the semiclassical Ehrenfest self-consistent potential method. The NDM method is similar in spirit to two recently developed methods, the continuous surface switching (CSS) and continuous...
Gespeichert in:
| Veröffentlicht in: | The Journal of chemical physics 2001-06, Vol.114 (21), p.9305-9314 |
|---|---|
| Hauptverfasser: | , |
| Format: | Artikel |
| Sprache: | eng |
| Online-Zugang: | Volltext |
| Tags: |
Tag hinzufügen
Keine Tags, Fügen Sie den ersten Tag hinzu!
|
Schreiben Sie den ersten Kommentar!