Abstract
The quasi-classical trajectory method is used in conjunction with a globally determined ab initio surface to study translational to vibrational excitation in collisions of hot H atoms with CO. Good agreement with experiment is obtained. Sensitivity of the results to features of the surface is analyzed.
| Original language | English |
|---|---|
| Pages (from-to) | 520-525 |
| Number of pages | 6 |
| Journal | Chemical Physics Letters |
| Volume | 114 |
| Issue number | 5-6 |
| DOIs | |
| Publication status | Published - Mar 15 1985 |
ASJC Scopus subject areas
- Physical and Theoretical Chemistry
- Spectroscopy
- Condensed Matter Physics
- Atomic and Molecular Physics, and Optics
- Surfaces and Interfaces
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Geiger, L. C., Schatz, G. C., & Harding, L. B. (1985). A quasi-classical trajectory study of collisions of fast H atoms with CO using an accurate ab initio potential surface. Chemical Physics Letters, 114(5-6), 520-525. https://doi.org/10.1016/0009-2614(85)85133-2