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arXiv:2407.17886 · Quantum Science and Technology

Pseudomode treatment of strong-coupling quantum thermodynamics

Francesco Albarelli, Bassano Vacchini, Andrea Smirne

Published Nov 21, 2024• 11 citations
arXivHTMLPDF

Abstract

Abstract The treatment of quantum thermodynamic systems beyond weak coupling is of increasing relevance, yet extremely challenging. The evaluation of thermodynamic quantities in strong-coupling regimes requires a nonperturbative knowledge of the bath dynamics, which in turn relies on heavy numerical simulations. To tame these difficulties, considering thermal bosonic baths linearly coupled to the open system, we derive expressions for heat, work, and average system-bath interaction energy that only involve the autocorrelation function of the bath and two-time expectation values of system operators. We then exploit the pseudomode approach, which replaces the physical continuous bosonic bath with a small finite number of damped, possibly interacting, modes, to numerically evaluate these relevant thermodynamic quantities. We show in particular that this method allows for an efficient numerical evaluation of thermodynamic quantities in terms of one-time expectation values of the open system and the pseudomodes. We apply this framework to the investigation of two paradigmatic situations. In the first instance, we study the entropy production for a two-level system (TLS) coupled to an ohmic bath, simulated via interacting pseudomodes, allowing for the presence of time-dependent driving. Secondly, we consider a quantum thermal machine composed of a TLS interacting with two thermal baths at different temperatures, showing that an appropriate sinusoidal modulation of the coupling with the cold bath only is enough to obtain work extraction.

DOI
10.1088/2058-9565/ad9499

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Abstract The treatment of quantum thermodynamic systems beyond weak coupling is of increasing relevance, yet extremely challenging. The evaluation of thermodynamic quantities in strong-coupling regimes requires a nonperturbative knowledge of the bath dynamics, which in turn relies on heavy numerical simulations. To tame these difficulties, considering thermal bosonic baths linearly coupled to the open system, we derive expressions for heat, work, and average system-bath interaction energy that only involve the autocorrelation function of the bath and two-time expectation values of system operators. We then exploit the pseudomode approach, which replaces the physical continuous bosonic bath with a small finite number of damped, possibly interacting, modes, to numerically evaluate these relevant thermodynamic quantities. We show in particular that this method allows for an efficient numerical evaluation of thermodynamic quantities in terms of one-time expectation values of the open system and the pseudomodes. We apply this framework to the investigation of two paradigmatic situations. In the first instance, we study the entropy production for a two-level system (TLS) coupled to an ohmic bath, simulated via interacting pseudomodes, allowing for the presence of time-dependent driving. Secondly, we consider a quantum thermal machine composed of a TLS interacting with two thermal baths at different temperatures, showing that an appropriate sinusoidal modulation of the coupling with the cold bath only is enough to obtain work extraction.
Pseudomode approaches allow for an exact and unapproximated description of a quantum system interacting arbitrarily strongly with a bath. In general, a system coupled to pseudomodes will not thermalize to the system's Gibbs state: This is to be expected when the system-bath coupling is non-perturbative, but conflicts with common thermodynamic intuition when the system-bath coupling is asymptotically weak. We explore under which circumstances pseudomode models satisfy detailed balance (and subsequently thermalize to the system Gibbs state) and how specific choices of parameters can force "weak" detailed balance that is restricted to a limited frequency range. A combination of Hermitian and non-Hermitian pseudomodes that yields a flat effective-temperature profile is also considered. The results and criteria established here are relevant for the construction of pseudomode models in contexts where thermodynamic consistency is required.
The pseudomode framework provides an exact description of the dynamics of an open quantum system coupled to a non-Markovian environment. Using this framework, the influence of the environment on the system is studied in an equivalent model, where the open system is coupled to a finite number of unphysical pseudomodes that follow a time-local master equation. Building on the insight that this master equation does not need to conserve the hermiticity of the pseudomode state, we here ask for the most general conditions on the master equation that guarantee the correct reproduction of the system's original dynamics. We demonstrate that our generalized approach decreases the number of pseudomodes that are required to model, for example, underdamped environments at finite temperature. We also provide an unraveling of the master equation into quantum jump trajectories of non-Hermitian states, which further facilitates the utilization of the pseudomode technique for numerical calculations by enabling the use of easily parallelizable Monte Carlo simulations. Finally, we show that pseudomodes, despite their unphysical nature, provide a natural picture in which physical processes, such as the creation of system-bath correlations or the exchange of heat, can be studied. Hence, our results pave the way for future investigations of the system-environment interaction leading to a better understanding of open quantum systems far from the Markovian weak-coupling limit. Published by the American Physical Society 2024
The focus is on understanding the quantum thermodynamics of strongly coupled non-Markovian quantum systems. To this end, a non-trivial, non-Markovian model of a central spin surrounded by a spin bath is taken up, and its exact evolution is derived for arbitrary system-bath couplings. The fundamental quantum thermodynamic quantities, such as system and bath internal energies, work, heat, entropy production, and ergotropy, are calculated using the dynamics and the original system (bath) Hamiltonian. An explicit expression for the work, a mismatch between the system and bath internal energies, is derived. The thermodynamic entropy of the system at thermal equilibrium is studied using the Hamiltonian of mean force in the strong coupling regime. The role of a canonical Hamiltonian in calculating the above thermodynamic quantities, a recently developed technique, is also investigated. Furthermore, an interesting observation relevant to the spin bath acting as a charger is made in a scenario where the central spin is envisaged as a quantum battery.
We study the energy exchange between two bosonic systems that interact via bilinear transformations in the mode operators. The first mode is considered as the thermodynamic system, while the second is regarded as the bath. This work finds its roots in a very recent formulation of quantum thermodynamics [Bera et al., Quantum 3, 121 (2019)] which allows one to consider baths that are not described by the usual Boltzmann-Gibbs canonical form. Baths can possess quantum properties, such as squeezing or coherence, and can be initially correlated with the system, even through entanglement. We focus mainly on the case of Gaussian states, by quantifying the relation between their defining parameters, namely the mean values of the quadratures and the covariance matrix, and relevant thermodynamical quantities such as the heat exchanged and the work performed during the interaction process. We fully solve the case of initially uncorrelated Gaussian states and provide the most general form of the first law of thermodynamics in this case. We also discuss the case of initially correlated states by considering a number of relevant examples, studying how correlations can assist some phenomena, e.g., work extraction or anomalous heat flows. Finally, we present an information-theoretic approach based on the Renyi entropy of order two for clarifying more generally the role of correlations on heat exchanges.
In this letter, we introduce a novel method for investigating dissipation (gain) and thermalization in an open quantum system. In this method, the quantum system is coupled linearly with a copy of itself or with another system described by a finite number of bosonic operators. The time-dependent coupling functions play a fundamental role in this scheme. To demonstrate the efficiency and significance of the method, we apply it to some ubiquitous open quantum systems. Firstly, we investigate a quantum oscillator in the presence of a thermal bath at the inverse temperature βββ, obtaining the reduced density matrix, the Husimi distribution function, and the quantum heat distribution function accurately. The results are consistent with existing literature by appropriate choices for the time-dependent coupling function. To illustrate the generalizability of this method to systems interacting with multiple thermal baths, we study the interaction of a quantum oscillator with two thermal baths at different temperatures and obtain compatible results. Subsequently, we analyze a two-level atom with energy or phase dissipation and derive the spontaneous emission and the pure dephasing processes consistently using the new method. Finally, we investigate the Markovianity in a dissipative two-level system.
How much work can be extracted from a heat bath using a thermal machine? The study of this question has a very long history in statistical physics in the weak-coupling limit, when applied to macroscopic systems. However, the assumption that thermal heat baths remain uncorrelated with associated physical systems is less reasonable on the nano-scale and in the quantum setting. In this work, we establish a framework of work extraction in the presence of quantum correlations. We show in a mathematically rigorous and quantitative fashion that quantum correlations and entanglement emerge as limitations to work extraction compared to what would be allowed by the second law of thermodynamics. At the heart of the approach are operations that capture the naturally non-equilibrium dynamics encountered when putting physical systems into contact with each other. We discuss various limits that relate to known results and put our work into the context of approaches to finite-time quantum thermodynamics.