Semiquantal analysis of a double-well coupled to dissipative bath: effective potential and coupled generalized Langevin equations

被引:16
作者
Ando, K [1 ]
机构
[1] Univ Birmingham, Sch Chem Sci, Birmingham B15 2TT, W Midlands, England
基金
英国工程与自然科学研究理事会;
关键词
D O I
10.1016/S0009-2614(03)01024-8
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 semiquantal theory is applied to a double-well potential coupled to dissipative bath. The analysis demonstrates in a comprehensive way how the quantum effect, e.g., the spreading of the wave packet width, is suppressed along the bath coupling strength. A quasi-classical approximation is introduced to derive a compact analytical formula, by which the kinetic isotope effects are briefly discussed. The coupled generalized Langevin equations indicate that the auxiliary semiquantal coordinates modulate the effective barrier frequency along the system coordinate, basically to reduce the frequency and thus to enhance the dynamical friction effect. (C) 2003 Elsevier B.V. All rights reserved.
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页码:532 / 537
页数:6
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