A classical approach to resonant low-energy electron scattering off molecules: Application to the a(1)-shape resonance of CF3Cl

被引：16

作者：

Lehr, L ^{[1
]}

Manz, J ^{[1
]}

Miller, WH ^{[1
]}

机构：

[1] UNIV CALIF BERKELEY, DEPT CHEM, BERKELEY, CA 94720 USA

来源：

CHEMICAL PHYSICS | 1997年 / 214卷 / 2-3期

关键词：

D O I：

10.1016/S0301-0104(96)00311-4

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

A recently presented classical theory of dissociative electron attachment (DA) [1] is extended to resonant elastic scattering (ES), vibrational excitation (VE), and superelastic scattering (SE). Cross sections sigma(upsilon i-->upsilon f) are calculated. As was done in the case of the theory of DA, the model is applied to the al-shape resonance of CF3Cl. Theoretical cross sections sigma(ES)(300K) and sigma(VE)(300K) are compared with the experimental ones [2]. Predictions are made on sigma(SE)(300K) and on the temperature dependence of all three cross sections.

引用

页码：301 / 312

页数：12

共 24 条

[1]

[Anonymous], ELECTRON MOL PHOTON

[2] DISSOCIATIVE ELECTRON-TRANSFER - ABINITIO STUDY OF THE CARBON HALOGEN BOND REDUCTIVE CLEAVAGE IN METHYL AND PERFLUOROMETHYL HALIDES - ROLE OF THE SOLVENT [J].