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arXiv:cond-mat/9901265 · Physical review. E, Statistical physics, plasmas, fluids, and related interdisciplinary topics

Thermodynamics of quantum dissipative many-body systems

Alessandro Cuccoli, Andrea Fubini, V. Tognetti, Ruggero Vaia

Published Jul 1, 1999• 10 citations
arXivHTMLPDF

Abstract

We consider quantum nonlinear many-body systems with dissipation described within the Caldeira-Leggett model, i.e., by a nonlocal action in the path integral for the density matrix. Approximate classical-like formulas for thermodynamic quantities are derived for the case of many degrees of freedom, with general kinetic and dissipative quadratic forms. The underlying scheme is the pure-quantum self-consistent harmonic approximation (PQSCHA), equivalent to the variational approach by the Feynman-Jensen inequality with a suitable quadratic nonlocal trial action. A low-coupling approximation permits us to get manageable PQSCHA expressions for quantum thermal averages with a classical Boltzmann factor involving an effective potential and an inner Gaussian average that describes the fluctuations originating from the interplay of quanticity and dissipation. The application of the PQSCHA to a quantum phi(4) chain with Drude-like dissipation shows nontrivial effects of dissipation, depending upon its strength and bandwidth.

DOI
10.1103/physreve.60.231

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We consider quantum nonlinear many-body systems with dissipation described within the Caldeira-Leggett model, i.e., by a nonlocal action in the path integral for the density matrix. Approximate classical-like formulas for thermodynamic quantities are derived for the case of many degrees of freedom, with general kinetic and dissipative quadratic forms. The underlying scheme is the pure-quantum self-consistent harmonic approximation (PQSCHA), equivalent to the variational approach by the Feynman-Jensen inequality with a suitable quadratic nonlocal trial action. A low-coupling approximation permits us to get manageable PQSCHA expressions for quantum thermal averages with a classical Boltzmann factor involving an effective potential and an inner Gaussian average that describes the fluctuations originating from the interplay of quanticity and dissipation. The application of the PQSCHA to a quantum phi(4) chain with Drude-like dissipation shows nontrivial effects of dissipation, depending upon its strength and bandwidth.
We address the possibility of performing numerical Monte Carlo simulations for the thermodynamics of quantum dissipative systems. Dissipation is considered within the Caldeira-Leggett formulation, which describes the system in the path-integral formalism through the inclusion of an influence action that is bilocal and quadratic in the system's coordinates. At a first sight the usual direct approach of discretizing the path integral could seem feasible, but complications arise when one tries to introduce a physically meaningful dissipation kernel: in particular its imaginary-time dependence turns out to be severely singular and difficult to evaluate analytically, in spite of the simple expressions for its Matsubara components. We therefore propose to face the numerical problem using Fourier path-integral Monte Carlo, that can be formulated in two different ways: transforming the continuous paths and then truncating the high Fourier components (with possible improvements upon the truncation procedure), or performing the Fourier transformation upon the discretized paths. The latter choice leads to a simpler formulation and allows for a better control of the extrapolation to the limit of infinite Trotter number. The method is implemented for a single nonlinear particle with Ohmic dissipation and for a phi(4) chain with Drude-like dissipation.
We study the quantum counterpart of the theorem on energy equipartition for classical systems. We consider a free quantum Brownian particle modeled in terms of the Caldeira-Leggett framework: a system plus thermostat consisting of an infinite number of harmonic oscillators. By virtue of the theorem on the averaged kinetic energy Ek{E}_{k}Ek​ of the quantum particle, it is expressed as ${E}_{k}=\ensuremath{\langle}{\mathcal{E}}_{k}\ensuremath{\rangle}$, where Ek{\mathcal{E}}_{k}Ek​ is the thermal kinetic energy of the thermostat per 1 degree of freedom and $\ensuremath{\langle}\ensuremath{\cdots}\ensuremath{\rangle}$ denotes averaging over the frequencies $\ensuremath{\omega}$ of thermostat oscillators which contribute to Ek{E}_{k}Ek​ according to the probability distribution $\mathbb{P}(\ensuremath{\omega})$. We explore the impact of various dissipation mechanisms, via the Drude, Gaussian, algebraic, and Debye spectral density functions, on the characteristic features of $\mathbb{P}(\ensuremath{\omega})$. The role of the system-thermostat coupling strength and the memory time on the most probable thermostat oscillator frequency as well as the kinetic energy Ek{E}_{k}Ek​ of the Brownian particle is analyzed.
Abstract We address the possibility of performing numerical Monte Carlo simulations for the thermodynamics of quantum dissipative systems. Dissipation is considered within the Caldeira–Leggett formulation, which describes the system in the path‐integral formalism through the inclusion of an influence action that is bilocal and quadratic in the system's coordinates. At a first sight the usual direct approach of discretizing the path integral could seem feasible, but complications arise when one tries to introduce a physically meaningful dissipation kernel: in particular its imaginary‐time dependence turns out to be severely singular and difficult to evaluate analytically, in spite of the simple expressions for its Matsubara components. We therefore propose to face the numerical problem using Fourier path‐integral Monte Carlo, that can be formulated in two different ways: transforming the continuous paths and then truncating the high Fourier components (with possible improvements upon the truncation procedure), or performing the Fourier transformation upon the discretized paths. The latter choice leads to a simpler formulation and allows for a better control of the extrapolation to the limit of infinite Trotter number. The method is implemented for a single nonlinear particle with Ohmic dissipation and for a ϕ4 chain with Drude‐like dissipation.
The standard system-plus-reservoir approach used in the study of dissipative systems can be meaningfully generalized to a dissipative coupling involving the momentum, instead of the coordinate: the corresponding equation of motion differs from the Langevin equation, so this is called anomalous dissipation. It occurs for systems where such coupling can indeed be derived from the physical analysis of the degrees of freedom that can be treated as a dissipation bath. Starting from the influence functional corresponding to anomalous dissipation, it is shown how to derive the effective classical potential that gives the quantum thermal averages for the dissipative system in terms of classical-like calculations; the generalization to many degrees of freedom is given. The formalism is applied to a single particle in a double well and to the discrete phi(4) model. At variance with the standard case, the fluctuations of the coordinate are enhanced by anomalous dissipative coupling.
Building upon the work of Hu, Paz, and Zhang [1,2] on open quantum systems we consider the quantum Brownian motion (QBM) model with one oscillator (position variable xxx) as the system, {\it nonlinearly} coupled to an environment of NNN harmonic oscillators (with mass mnm_nmn​, natural frequency ωnω_nωn​, position qnq_nqn​ and momentum pnp_npn​ variables) in the form ∑n(vn1(x)qnk+vn2(x)pnl)\sum_{n}\left(v_{n1}(x)q_{n}^{k}+v_{n2}(x)p_{n}^{l}\right)∑n​(vn1​(x)qnk​+vn2​(x)pnl​) where k,lk, lk,l are integers (the present work only considers the k=l=2k=l=2k=l=2 cases). The vertex functions $v_{n1}, v_{n2} $ are of the form vn1=λCn1f(x),vn2(x)=−λ Cn2mn−2ωn−2f(x)v_{n1}=λC_{n1} f(x), v_{n2}(x)=-λ\,C_{n2}m_{n}^{-2}ω_{n}^{-2}f(x)vn1​=λCn1​f(x),vn2​(x)=−λCn2​mn−2​ωn−2​f(x) where Cn1,2C_{n1,2}Cn1,2​ are the coupling constants with the nnnth oscillator, f(x)f(x)f(x) is any arbitrary function of xxx, and λλλ is a dimensionless constant. Employing the closed-time-path formalism the influence action SIFS_{IF}SIF​ is calculated using a perturbative expansion in λλλ. It is possible to identify the terms in SIFS_{IF}SIF​ quadratic or higher in Δ(s)≡f(x+(s))−f(x−(s))Δ(s)\equiv f(x_{+}(s))-f(x_{-}(s))Δ(s)≡f(x+​(s))−f(x−​(s)) to constitute the noise kernel, while terms linear in ΔΔΔ to that of the dissipation kernel. The non-Gaussian noise kernel gives rise to non-zero three-point correlation function of the corresponding stochastic force. The pathway presented here should be useful for the exploration of \textit{non-Gaussian properties of systems nonlinearly coupled with their environments}; examples in early universe cosmology and in quantum optomechanics (QOM) are mentioned. A modified fluctuation-dissipation relation (FDR) is also established, which ensures the consistency of the model and the accuracy of results even at higher perturbative orders. Another result of significance is the derivation of a nonlinear Langevin equation which is expected to be useful for many open quantum system applications.