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arXiv:1905.11119 · Physical Review A

Accessing the bath information in open quantum systems with the stochastic c -number Langevin equation method

Zheng-Yang Zhou, Yun‐An Yan, Stephen Hughes, J. Q. You, Franco Nori

Published Oct 14, 2019• 7 citations
arXivHTMLPDF

Abstract

In traditional open quantum systems, the baths are usually traced out so that only the system information is left in the equations of motion. However, recent studies reveal that using only the system degrees of freedom can be insufficient. In this work, we develop a stochastic $c$-number Langevin equation method which can conveniently access the bath information. In our approach, the studied quantities are the expectation values of operators which can contain both system operators and bath operators. The dynamics of the operators of interest is formally divided into separate system and bath parts, with auxiliary stochastic fields. After solving the independent stochastic dynamics of the system part and the bath part, we can recombine them by taking the average over these stochastic fields to obtain the desired quantities. Several applications of the theory are highlighted, including the pure dephasing model, the spin-boson model, and an optically excited quantum dot coupled to a bath of phonons.

DOI
10.1103/physreva.100.042112

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In traditional open quantum systems, the baths are usually traced out so that only the system information is left in the equations of motion. However, recent studies reveal that using only the system degrees of freedom can be insufficient. In this work, we develop a stochastic ccc-number Langevin equation method which can conveniently access the bath information. In our approach, the studied quantities are the expectation values of operators which can contain both system operators and bath operators. The dynamics of the operators of interest is formally divided into separate system and bath parts, with auxiliary stochastic fields. After solving the independent stochastic dynamics of the system part and the bath part, we can recombine them by taking the average over these stochastic fields to obtain the desired quantities. Several applications of the theory are highlighted, including the pure dephasing model, the spin-boson model, and an optically excited quantum dot coupled to a bath of phonons.
We derive a ccc-number generalized Langevin equation (GLE) describing the evolution of the expectation values ${\ensuremath{\langle}{x}_{i}\ensuremath{\rangle}}_{t}$ of the atomic position operators xi{x}_{i}xi​ of an open system. The latter is coupled linearly to a harmonic bath kept at a fixed temperature. The equations of motion contain a non-Markovian friction term with the classical kernel [L. Kantorovich, Phys. Rev. B 78, 094304 (2008)] and a zero mean non-Gaussian random force with correlation functions that depend on the initial preparation of the open system. We used a density operator formalism without assuming that initially the combined system was decoupled. The only approximation made in deriving quantum GLE consists of assuming that the Hamiltonian of the open system at time ttt can be expanded up to the second order with respect to operators of atomic displacements ${u}_{i}={x}_{i}\ensuremath{-}{\ensuremath{\langle}{x}_{i}\ensuremath{\rangle}}_{t}$ in the open system around their exact atomic positions ${\ensuremath{\langle}{x}_{i}\ensuremath{\rangle}}_{t}$ (the ``harmonization'' approximation). The noise is introduced to ensure that sampling many quantum GLE trajectories yields exactly the average one. An explicit expression for the pair correlation function of the noise, consistent with the classical limit, is also proposed. Unlike the usually considered quantum operator GLE, the proposed ccc-number quantum GLE can be used in direct molecular dynamic simulations of open systems under general equilibrium or nonequilibrium conditions.
One longstanding difficult problem in quantum dissipative dynamics is to solve the spin-boson model in a non-Markovian regime where a tractable systematic master equation does not exist. The spin-boson model is particularly important due to its crucial applications in quantum noise control and manipulation as well as its central role in developing quantum theories of open systems. Here we solve this important model by developing a non-Markovian quantum Langevin approach. By projecting the quantum Langevin equation onto the coherent states of the bath, we can derive a set of non-Markovian quantum Bloch equations containing no explicit noise variables. This special feature offers a tremendous advantage over the existing stochastic Schr\"odinger equations in numerical simulations. The physical significance and generality of our approach are briefly discussed.
In this work, we introduce a method for deriving exact master equations from the dynamical map for finite open quantum systems coupled to (in)finite reservoirs, using the principle of minimal dissipation. The exact dynamics of the central spin model, which models a finite-bath open quantum system, is developed for two interaction types: Heisenberg and stochastic pure-dephasing interactions. The Heisenberg interaction yields a novel phase-covariant quantum channel in the strong-coupling regime, offering a new platform for studying a range of quantum information protocols. The stochastic pure-dephasing interaction provides the microscopic derivation of the paradigmatic non-Markovian random telegraph noise (RTN) channel, establishing its quantum foundation and offering insight into stochastic couplings. We derive the closed-form master equations for both models. As a demonstration, we explore the thermodynamic performance of these systems as quantum batteries. A direct relationship between quantum heat current and charging power is revealed, and RTN quantum batteries are shown to have advantages in charge storage.
We present a simple and effective approach for extracting the bath information in open-quantum-system dynamics under the framework of the numerically exact hierarchical equations-of-motion method, for which it is usually not straightforward to adjust the boundary between the system and bath. The key component of our approach is an additional bath mode that weakly interacts with the system through the same coupling channel as the mode of interest, which we call the probe mode. By combining the probe mode with the system and calculating its expectation value, we can deduce the corresponding expectation value of the mode of interest via simple relations. The effectiveness of our approach is demonstrated by exact decomposition of dissipation by a continuous spectral density.
Classical Brownian motion has well been investigated since the pioneering work of Einstein, which inspired mathematicians to lay the theoretical foundation of stochastic processes. A stochastic formulation for quantum dynamics of dissipative systems described by the system-plus-bath model has been developed and found many applications in chemical dynamics, spectroscopy, quantum transport, and other fields. This article provides a tutorial review of the stochastic formulation for quantum dissipative dynamics. The key idea is to decouple the interaction between the system and the bath by virtue of the Hubbard-Stratonovich transformation or Itô calculus so that the system and the bath are not directly entangled during evolution, rather they are correlated due to the complex white noises introduced. The influence of the bath on the system is thereby defined by an induced stochastic field, which leads to the stochastic Liouville equation for the system. The exact reduced density matrix can be calculated as the stochastic average in the presence of bath-induced fields. In general, the plain implementation of the stochastic formulation is only useful for short-time dynamics, but not efficient for long-time dynamics as the statistical errors go very fast. For linear and other specific systems, the stochastic Liouville equation is a good starting point to derive the master equation. For general systems with decomposable bath-induced processes, the hierarchical approach in the form of a set of deterministic equations of motion is derived based on the stochastic formulation and provides an effective means for simulating the dissipative dynamics. A combination of the stochastic simulation and the hierarchical approach is suggested to solve the zero-temperature dynamics of the spin-boson model. This scheme correctly describes the coherent-incoherent transition (Toulouse limit) at moderate dissipation and predicts a rate dynamics in the overdamped regime. Challenging problems such as the dynamical description of quantum phase transition (local- ization) and the numerical stability of the trace-conserving, nonlinear stochastic Liouville equation are outlined.
A system of spins coupled to a bath is a traditional setup in open quantum systems. Through Heisenberg's equation, the spin dynamics can be modeled by a set of first-order differential equations. Interpreting the terms as colored noise and non-Markovian damping, one can write them as quantummechanical Heisenberg-Langevin (HL) equations. These are notoriously difficult to solve because of the high dimensionality of the Hilbert space. Classical generalized Langevin equations, involving non-Markovian damping and colored noise, are well understood and can be treated numerically with relative ease. Thus, a classical ansatz can be made by substituting quantum expectation values with classical functions. This allows the application of standard methods developed for classical stochastic dynamical systems to tackle spin dynamics. However, this approach is uncontrolled and should be benchmarked against known quantum dynamics. In this investigation, a Hamiltonian for spin dynamics is modified to obtain a setup analogous to the Weisskopf-Wigner (WW) theory of spontaneous emission, enabling a comparison of the results. This will be compared for T = 0 and with a slight adaptation in the high-temperature limit.