A semiclassical model is used to calculate the tunneling splitting in a model of the malonaldehyde molecule to determine the extent to which mode-specific behavior might exist for malonaldehyde and other topologically similar systems. Ensembles of 2500 classical trajectories corresponding to various
โฆ LIBER โฆ
Computer study of a semiclassical model of the dynamical water molecule
โ Scribed by D. Greenspan
- Publisher
- Elsevier Science
- Year
- 1993
- Tongue
- English
- Weight
- 456 KB
- Volume
- 26
- Category
- Article
- ISSN
- 0898-1221
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