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An extension of stochastic hierarchy equations of motion for the equilibrium correlation functions

机译:平衡相关函数的运动随机分层方程的扩展

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摘要

A traditional stochastic hierarchy equations of motion method is extended into the correlated real-time and imaginary-time propagations, in this paper, for its applications in calculating the equilibrium correlation functions. The central idea is based on a combined employment of stochastic unravelling and hierarchical techniques for the temperature-dependent and temperature-free parts of the influence functional, respectively, in the path integral formalism of the open quantum systems coupled to a harmonic bath. The feasibility and validity of the proposed method are justified in the emission spectra of homodimer compared to those obtained through the deterministic hierarchy equations of motion. Besides, it is interesting to find that the complex noises generated from a small portion of real-time and imaginary-time cross terms can be safely dropped to produce the stable and accurate position and flux correlation functions in a broad parameter regime.
机译:本文将传统的随机运动层次方程法扩展到相关的实时和虚时传播中,以用于计算平衡相关函数。中心思想是基于随机分解和分层技术的结合使用,分别用于影响函数的温度相关部分和无温度部分,在耦合至谐波浴的开放量子系统的路径积分形式中。与通过确定性运动层次方程获得的发射光谱相比,在同二聚体的发射光谱中证明了该方法的可行性和有效性。此外,有趣的是,可以安全地降低由实时和虚时交叉项的一小部分产生的复杂噪声,以在较宽的参数范围内产生稳定且准确的位置和磁通相关函数。

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