Abstract
Forward-backward semiclassical dynamics (FBSD) for condensed phase time correlation functions was studied. The method was straightforward to implement and provided an efficient tool for the calculation of correlation functions in large clusters, liquids or biological systems. The method was applied to the calculation of the velocity correlation function of liquid argon.
| Original language | English (US) |
|---|---|
| Pages (from-to) | 1634-1642 |
| Number of pages | 9 |
| Journal | Journal of Chemical Physics |
| Volume | 119 |
| Issue number | 3 |
| DOIs | |
| State | Published - Jul 15 2003 |
ASJC Scopus subject areas
- General Physics and Astronomy
- Physical and Theoretical Chemistry