Quantum effects in the capture of charged particles by dipolar polarizable symmetric top molecules. I. General axially nonadiabatic channel treatment

被引:12
作者
Auzinsh, M. [1 ]
Dashevskaya, E. I. [2 ,3 ]
Litvin, I. [3 ]
Nikitin, E. E. [2 ,3 ]
Troe, J. [3 ,4 ]
机构
[1] Latvian State Univ, Dept Phys, LV-1586 Riga, Latvia
[2] Technion Israel Inst Technol, Schulich Fac Chem, IL-32000 Haifa, Israel
[3] Max Planck Inst Biophys Chem, D-37077 Gottingen, Germany
[4] Univ Gottingen, Inst Phys Chem, D-37077 Gottingen, Germany
关键词
STATISTICAL ADIABATIC CHANNEL; RATE CONSTANTS; UNIMOLECULAR PROCESSES; SCHRODINGER-EQUATION; DYNAMIC ORIENTATION; TRIATOMIC COMPLEXES; ANGULAR-MOMENTUM; ION; MODEL; DECOMPOSITION;
D O I
10.1063/1.4819062
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 rate coefficients for capture of charged particles by dipolar polarizable symmetric top molecules in the quantum collision regime are calculated within an axially nonadiabatic channel approach. It uses the adiabatic approximation with respect to rotational transitions of the target within first-order charge-dipole interaction and takes into account the gyroscopic effect that decouples the intrinsic angular momentum from the collision axis. The results are valid for a wide range of collision energies (from single-wave capture to the classical limit) and dipole moments (from the Vogt-Wannier and fly-wheel to the adiabatic channel limit). (C) 2013 AIP Publishing LLC.
引用
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页数:10
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