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无界系统中的量子耗散。

Quantum dissipation in unbounded systems.

作者信息

Maddox Jeremy B, Bittner Eric R

机构信息

Department of Chemistry, University of Houston, Houston, Texas 77204, USA.

出版信息

Phys Rev E Stat Nonlin Soft Matter Phys. 2002 Feb;65(2 Pt 2):026143. doi: 10.1103/PhysRevE.65.026143. Epub 2002 Jan 25.

Abstract

In recent years trajectory based methodologies have become increasingly popular for evaluating the time evolution of quantum systems. A revival of the de Broglie--Bohm interpretation of quantum mechanics has spawned several such techniques for examining quantum dynamics from a hydrodynamic perspective. Using techniques similar to those found in computational fluid dynamics one can construct the wave function of a quantum system at any time from the trajectories of a discrete ensemble of hydrodynamic fluid elements (Bohm particles) which evolve according to nonclassical equations of motion. Until very recently these schemes have been limited to conservative systems. In this paper, we present our methodology for including the effects of a thermal environment into the hydrodynamic formulation of quantum dynamics. We derive hydrodynamic equations of motion from the Caldeira-Leggett master equation for the reduced density matrix and give a brief overview of our computational scheme that incorporates an adaptive Lagrangian mesh. Our applications focus upon the dissipative dynamics of open unbounded quantum systems. Using both the Wigner phase space representation and the linear entropy, we probe the breakdown of the Markov approximation of the bath dynamics at low temperatures. We suggest a criteria for rationalizing the validity of the Markov approximation in open unbound systems and discuss decoherence, energy relaxation, and quantum/classical correspondence in the context of the Bohmian paths.

摘要

近年来,基于轨迹的方法在评估量子系统的时间演化方面越来越受欢迎。德布罗意 - 玻姆对量子力学的解释的复兴催生了几种从流体动力学角度研究量子动力学的此类技术。使用与计算流体动力学中类似的技术,可以根据遵循非经典运动方程演化的流体动力学流体元素(玻姆粒子)的离散集合的轨迹,随时构建量子系统的波函数。直到最近,这些方案还仅限于保守系统。在本文中,我们提出了将热环境的影响纳入量子动力学流体动力学公式的方法。我们从用于约化密度矩阵的卡尔德雷拉 - 莱格特主方程导出流体动力学运动方程,并简要概述了我们结合自适应拉格朗日网格的计算方案。我们的应用集中在开放无界量子系统的耗散动力学上。使用维格纳相空间表示和线性熵,我们研究了低温下浴动力学的马尔可夫近似的失效情况。我们提出了一个使开放无界系统中马尔可夫近似有效性合理化的标准,并在玻姆路径的背景下讨论退相干、能量弛豫和量子/经典对应关系。

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