Path integral approximation of state- and angle-resolved inelastic scattering

Citation
Twj. Whiteley et Aj. Mccaffery, Path integral approximation of state- and angle-resolved inelastic scattering, J CHEM PHYS, 110(12), 1999, pp. 5548-5556
Citations number
39
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF CHEMICAL PHYSICS
ISSN journal
00219606 → ACNP
Volume
110
Issue
12
Year of publication
1999
Pages
5548 - 5556
Database
ISI
SICI code
0021-9606(19990322)110:12<5548:PIAOSA>2.0.ZU;2-H
Abstract
'We construct a path integral based approximation to rotationally inelastic collisions from which differential scattering cross sections are obtained for a number of atom-diatom systems. These are found to be in good agreemen t with IOS calculations on the same systems. In this approximation, the cla ssical and near-classical paths that control scattering from a quantized sy stem are deduced and this process reveals the origins of interference effec ts seen in theoretical calculations and some experimental measurements of a ngular distributions. This formulation provides physical insight into the i mportant trajectories in systems where one or more degrees of freedom are q uantized and could be regarded as an extension of classical S matrix theory , which for simple systems do not require root finding methods. (C) 1999 Am erican Institute of Physics. [S0021-9606(99)01612-8].