Quantum dynamical correlations: Effective potential analytic continuation approach

被引:15
作者
Horikoshi, A [1 ]
Kinugawa, K
机构
[1] Japan Sci & Technol Corp, Nara 6308506, Japan
[2] Nara Womens Univ, Fac Sci, Dept Chem, Nara 6308506, Japan
关键词
D O I
10.1063/1.1595638
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
We propose a new quantum dynamics method called the effective potential analytic continuation (EPAC) to calculate the real time quantum correlation functions at finite temperature. The method is based on the effective action formalism which includes the standard effective potential. The basic notions of the EPAC are presented for a one-dimensional double well system in comparison with the centroid molecular dynamics (CMD) and the exact real time quantum correlation function. It is shown that both the EPAC and the CMD well reproduce the exact short time behavior, while at longer time their results deviate from the exact one. The CMD correlation function damps rapidly with time because of ensemble dephasing. The EPAC correlation function, however, can reproduce the long time oscillation inherent in the quantum double well systems. It is also shown that the EPAC correlation function can be improved toward the exact correlation function by means of the higher order derivative expansion of the effective action. (C) 2003 American Institute of Physics.
引用
收藏
页码:4629 / 4640
页数:12
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