Two-dimensional model of molecule—surface scattering
✍ Scribed by Z. Bačić; S.D. Bosanac
- Publisher
- Elsevier Science
- Year
- 1984
- Tongue
- English
- Weight
- 381 KB
- Volume
- 105
- Category
- Article
- ISSN
- 0009-2614
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✦ Synopsis
Rotational excitation in molecule-su&m scattering is analyzed in a simple quantum two-dimensional model. The true molecule-smface potential is replaced by a hard-core ellipsokt. The model accurately describes the dominaut features of the transition probability distribution. Tbk is demonstrated by comparing rotational transition probabitities calculated from our mudel with the resutts of IOS calculations of Voges and Schinke using realistic potential. The model predicts a new scaling property mnmrning the anisotropy parameter of the potential surfam. 1. introduction A rapidly growing amount of experimental information regarding rotational energy transfer in moleculesurface collisions [l-l I] prompted a number of the-
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The dynamics of rotational excitation in rigid-rotor/rigid-surface scattering is investigated by comparison of quasi-classical trajectory and infinite-order-sudden calculations with exact close-couplins results usiq an anisotropic Morse potential. The influence of the potential surface attraction is
Classical trajectory and quantum-mechanical calculations of final rot&ional stale distributions are described for a simple model of the scattering of NO from A&l 11) which show strong effects of rotational rainbow% The quantum-mechanical calcularion reproduces the gcncral trends of the experimental