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arXiv:1806.08538 · Physical Review A

Stochastic decoupling approach to the spin-boson dynamics: Perturbative and nonperturbative treatments

Wei Wu

Published Sep 21, 2018• 8 citations
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Abstract

We develop a hierarchical functional derivative (HFD) method to investigate the reduced dynamics of a spin-boson model within the framework of a stochastic decoupling description. Keeping only the lowest-order truncation of the hierarchical functional derivatives, one can recover the second-order Nakajima-Zwanzig quantum master equation. Taking into account the higher-order corrections, our method can be implemented as a highly efficient numerical scheme for a general spin-boson model beyond the usual Markovian, rotating-wave, and weak-coupling approximations.

DOI
10.1103/physreva.98.032116

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We develop a hierarchical functional derivative (HFD) method to investigate the reduced dynamics of a spin-boson model within the framework of a stochastic decoupling description. Keeping only the lowest-order truncation of the hierarchical functional derivatives, one can recover the second-order Nakajima-Zwanzig quantum master equation. Taking into account the higher-order corrections, our method can be implemented as a highly efficient numerical scheme for a general spin-boson model beyond the usual Markovian, rotating-wave, and weak-coupling approximations.
A generalized master equation for the spin-boson model is proposed that does not require a perturbative treatment of the interstate or system-bath couplings. The nonperturbative formulation is based on the assumption of a decoupling of system and bath density operators, and results in a generalized memory function that reduces in the limit of weak system-bath coupling to the standard result of the perturbative non-interacting-blip approximation. Numerical studies in comparison to exact path-integral calculations demonstrate that the nonperturbative master equation represents a clear improvement to perturbation theory as long as the overall coupling is still small enough to justify the underlying decoupling assumption. Finally, possible generalizations of the method to the description of a dissipative N-level system and the limitations of the decoupling ansatz are discussed in some detail.
Solving realistic quantum systems coupled to an environment is a challenging task. Here we develop a hierarchical functional derivative (HFD) approach for efficiently solving the non-Markovian quantum trajectories of an open quantum system embedded in a bosonic bath. An explicit expression for arbitrary order HFD equation is derived systematically. Moreover, it is found that for an analytically solvable model, this hierarchical equation naturally terminates at a given order and thus becomes exactly solvable. This HFD approach provides a systematic method to study the non-Markovian quantum dynamics of an open system coupled to a bosonic environment.
We develop a systematic and efficient approach for numerically solving the non-Markovian quantum state diffusion equation for an open quantum system that can be strongly coupled to an environment. As an important application, we consider a real-time simulation of a spin-boson model in a strong-coupling regime that is difficult to deal with using conventional methods. We show that the non-Markovian stochastic Schr\"odinger equation can be efficiently implemented as a real-time simulation for this model, so as to give an accurate description of spin-boson dynamics beyond the rotating-wave approximation.
We develop a systematic and efficient approach for numerically solving the non-Markovian quantum state diffusion equations for open quantum systems coupled to an environment up to arbitrary orders of noises or coupling strengths. As an important application, we consider a real-time simulation of a spin-boson model in a strong coupling regime that is difficult to deal with using conventional methods. We show that the non-Markovian stochastic Schrodinger equation can be efficiently implemented as a real--time simulation for this model, so as to give an accurate description of spin-boson dynamics beyond the rotating-wave approximation.
The spin-boson model, describing a two-level system coupled to a bosonic bath, is extensively studied as a paradigmatic dissipative quantum system, exhibiting rich dynamical behavior and even a localization transition in the strong coupling regime. Here, we additionally consider dephasing as a source of Markovian dissipation on top of the non-Markovian dynamics due to an Ohmic bath, and investigate the dynamics of the spin. We show that the characteristic frequency of the spin dynamics, while strongly renormalized by the bosonic bath, changes in a simple fashion (or does not change at all) with dephasing. To obtain these results, we develop an exact nonperturbative method known as the stochastic Schr\"odinger equation, mimicking the Ohmic bath via a stochastic magnetic field combined with the Lindblad quantum master equation due to dephasing, which allows us to numerically compute the dynamics. Furthermore, we derive weak-coupling analytic results utilizing the well-known noninteracting blip approximation. Our findings are relevant to quantum simulation of the spin-boson model in the regime of strong coupling in trapped ions and circuit QED architectures among others.
The Nakajima-Zwanzig generalized master equation provides a formally exact framework to simulate quantum dynamics in condensed phases. Yet, the exact memory kernel is hard to obtain and calculations based on perturbative expansions are often employed. By using the spin-boson model as an example, we assess the convergence of high order memory kernels in the Nakajima-Zwanzig generalized master equation. The exact memory kernels are calculated by combining the hierarchical equation of motion approach and the Dyson expansion of the exact memory kernel. High order expansions of the memory kernels are obtained by extending our previous work to calculate perturbative expansions of open system quantum dynamics [M. Xu et al., J. Chem. Phys. 146, 064102 (2017)]. It is found that the high order expansions do not necessarily converge in certain parameter regimes where the exact kernel show a long memory time, especially in cases of slow bath, weak system-bath coupling, and low temperature. Effectiveness of the Padé and Landau-Zener resummation approaches is tested, and the convergence of higher order rate constants beyond Fermi's golden rule is investigated.