Generalization of the nonlocal resonance model for low-energy electron collisions with hydrogen halides:: the variable threshold exponent

被引:18
作者
Horácek, J
Cizek, M
Domcke, W [1 ]
机构
[1] Univ Dusseldorf, Inst Theoret Chem, D-40225 Dusseldorf, Germany
[2] Charles Univ Prague, Fac Math & Phys, CZ-18000 Prague 8, Czech Republic
关键词
electron; molecule scattering; threshold phenomena; resonance; nonlocal complex potential;
D O I
10.1007/s002140050363
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
The nonlocal resonance model developed previously for the description of low-energy electron collisions with hydrogen halides is generalized to include the dependence of the dipole-modified threshold exponent on the internuclear distance. An efficient computational scheme has been developed to deal with the resulting nonseparability of the nonlocal complex potential for the nuclear motion within the Schwinger-Lanczos approach. The results reveal that the R-dependence of the threshold exponent has a significant effect on the threshold peaks in the vibrational excitation cross sections of HCl. The shape and intensity of the calculated threshold peak in the 0 --> 1 vibrational excitation channel, in particular, are in much better agreement with experimental data than previous results. For the electron-HBr and electron-HI collision systems the effects of the R-dependence of the threshold exponent are not significant.
引用
收藏
页码:31 / 35
页数:5
相关论文
共 30 条
[1]   FINE-STRUCTURE IN THE DISSOCIATIVE ATTACHMENT CROSS-SECTIONS FOR HBR AND HF [J].
ABOUAF, R ;
TEILLETBILLY, D .
CHEMICAL PHYSICS LETTERS, 1980, 73 (01) :106-109
[3]  
CIZEK M, UNPUB
[4]   BOUND STATES OF A CHARGED PARTICLE IN A DIPOLE FIELD [J].
CRAWFORD, OH .
PROCEEDINGS OF THE PHYSICAL SOCIETY OF LONDON, 1967, 91 (572P) :279-&
[5]  
CVEJANOVIC S, 1993, 18 INT C EL AT COLL
[6]   ON THE INTERPRETATION OF LOW-ENERGY ELECTRON-HCL SCATTERING PHENOMENA [J].
DOMCKE, W ;
CEDERBAUM, LS .
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1981, 14 (01) :149-173
[7]  
DOMCKE W, 1990, AIP CONF PROC, V204, P169, DOI 10.1063/1.39189
[9]   THEORY OF RESONANCE AND THRESHOLD EFFECTS IN ELECTRON MOLECULE COLLISIONS - THE PROJECTION-OPERATOR APPROACH [J].
DOMCKE, W .
PHYSICS REPORTS-REVIEW SECTION OF PHYSICS LETTERS, 1991, 208 (02) :97-188
[10]  
Fabrikant I. I., 1990, Comments on Atomic and Molecular Physics, V24, P37