Abstract
A computational method is described which enables visualization of the coordinate space envelopes of classical trajectories in multidimensional bound molecular systems. The method is exemplified by application to a realistic three-dimensional model of the vibrating water molecule, and its utility in the application of semiclassical quantization techniques is emphasized.
| Original language | English |
|---|---|
| Pages (from-to) | 2738-2744 |
| Number of pages | 7 |
| Journal | Journal of Physical Chemistry |
| Volume | 87 |
| Issue number | 15 |
| Publication status | Published - 1983 |
ASJC Scopus subject areas
- Physical and Theoretical Chemistry