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arXiv:1005.0393 · Progress of Theoretical Physics

Introduction to Nonequilibrium Statistical Mechanics with Quantum Field Theory

T. Kita

Published Apr 1, 2010• 83 citations
arXivHTMLPDF

Abstract

In this article, we present a concise and self-contained introduction to nonequilibrium statistical mechanics with quantum field theory by considering an ensemble of interacting identical bosons or fermions as an example. Readers are assumed to be familiar with the Matsubara formalism of equilibrium statistical mechanics such as Feynman diagrams, the proper self-energy, and Dyson's equation. The aims are threefold: (i) to explain the fundamentals of nonequilibrium quantum field theory as simple as possible on the basis of the knowledge of the equilibrium counterpart; (ii) to elucidate the hierarchy in describing nonequilibrium systems from Dyson's equation on the Keldysh contour to the Navier-Stokes equation in fluid mechanics via quantum transport equations and the Boltzmann equation; (iii) to derive an expression of nonequilibrium entropy that evolves with time. In stage (i), we introduce nonequilibrium Green's function and the self-energy uniquely on the round-trip Keldysh contour, thereby avoiding possible confusions that may arise from defining multiple Green's functions at the very beginning. We try to present the Feynman rules for the perturbation expansion as simple as possible. In particular, we focus on the self-consistent perturbation expansion with the Luttinger-Ward thermodynamic functional, i.e., Baym's Phi-derivable approximation, which has a crucial property for nonequilibrium systems of obeying various conservation laws automatically. We also show how the two-particle correlations can be calculated within the Phi-derivable approximation, i.e., an issue of how to handle the "Bogoliubov-Born-Green-Kirkwood-Yvons (BBGKY) hierarchy".

DOI
10.1143/ptp.123.581

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In this article, we present a concise and self-contained introduction to nonequilibrium statistical mechanics with quantum field theory by considering an ensemble of interacting identical bosons or fermions as an example. Readers are assumed to be familiar with the Matsubara formalism of equilibrium statistical mechanics such as Feynman diagrams, the proper self-energy, and Dyson's equation. The aims are threefold: (i) to explain the fundamentals of nonequilibrium quantum field theory as simple as possible on the basis of the knowledge of the equilibrium counterpart; (ii) to elucidate the hierarchy in describing nonequilibrium systems from Dyson's equation on the Keldysh contour to the Navier-Stokes equation in fluid mechanics via quantum transport equations and the Boltzmann equation; (iii) to derive an expression of nonequilibrium entropy that evolves with time. In stage (i), we introduce nonequilibrium Green's function and the self-energy uniquely on the round-trip Keldysh contour, thereby avoiding possible confusions that may arise from defining multiple Green's functions at the very beginning. We try to present the Feynman rules for the perturbation expansion as simple as possible. In particular, we focus on the self-consistent perturbation expansion with the Luttinger-Ward thermodynamic functional, i.e., Baym's Phi-derivable approximation, which has a crucial property for nonequilibrium systems of obeying various conservation laws automatically. We also show how the two-particle correlations can be calculated within the Phi-derivable approximation, i.e., an issue of how to handle the "Bogoliubov-Born-Green-Kirkwood-Yvons (BBGKY) hierarchy".
Entropy in nonequilibrium statistical mechanics is investigated theoretically so as to extend the well-established equilibrium framework to open nonequilibrium systems. We first derive a microscopic expression of nonequilibrium entropy for an assembly of identical bosons/fermions interacting via a two-body potential. This is performed by starting from the Dyson equation on the Keldysh contour and following closely the procedure of Ivanov, Knoll and Voskresensky [Nucl. Phys. A {\bf 672} (2000) 313]. The obtained expression is identical in form with an exact expression of equilibrium entropy and obeys an equation of motion which satisfies the HHH-theorem in a limiting case. Thus, entropy can be defined unambiguously in nonequilibrium systems so as to embrace equilibrium statistical mechanics. This expression, however, differs from the one obtained by Ivanov {\em et al}., and we show explicitly that their ``memory corrections'' are not necessary. Based on our expression of nonequilibrium entropy, we then propose the following principle of maximum entropy for nonequilibrium steady states: ``The state which is realized most probably among possible steady states without time evolution is the one that makes entropy maximum as a function of mechanical variables, such as the total particle number, energy, momentum, energy flux, etc.'' During the course of the study, we also develop a compact real-time perturbation expansion in terms of the matrix Keldysh Green's function.
The self-energy functional theory (SFT) is generalized to describe the real-time dynamics of correlated lattice-fermion models far from thermal equilibrium. This is achieved by starting from a reformulation of the original equilibrium theory in terms of double-time Green's functions on the Keldysh-Matsubara contour. With the help of a generalized Luttinger-Ward functional, we construct a functional $\stackrel{\ifmmode \hat{}\else \^{}\fi{}}{\ensuremath{\Omega}}[\ensuremath{\Sigma}]$ which is stationary at the physical (nonequilibrium) self-energy $\ensuremath{\Sigma}$ and which yields the grand potential of the initial thermal state $\ensuremath{\Omega}$ at the physical point. Nonperturbative approximations can be defined by specifying a reference system that serves to generate trial self-energies. These self-energies are varied by varying the reference system's one-particle parameters on the Keldysh-Matsubara contour. In the case of thermal equilibrium, this approach reduces to the conventional SFT. Contrary to the equilibrium theory, however, ``unphysical'' variations, i.e., variations that are different on the upper and the lower branches of the Keldysh contour, must be considered to fix the time dependence of the optimal physical parameters via the variational principle. Functional derivatives in the nonequilibrium SFT Euler equation are carried out analytically to derive conditional equations for the variational parameters that are accessible to a numerical evaluation via a time-propagation scheme. Approximations constructed by means of the nonequilibrium SFT are shown to be inherently causal, internally consistent, and to respect macroscopic conservation laws resulting from gauge symmetries of the Hamiltonian. This comprises the nonequilibrium dynamical mean-field theory but also dynamical-impurity and variational-cluster approximations that are specified by reference systems with a finite number of degrees of freedom. In this way, nonperturbative and consistent approximations can be set up, the numerical evaluation of which is accessible to an exact-diagonalization approach.
The Green's function method is one of the most powerful and versatile formalisms in physics, and its nonequilibrium version has proved invaluable in many research fields. This book provides a unique, self-contained introduction to nonequilibrium many-body theory. Starting with basic quantum mechanics, the authors introduce the equilibrium and nonequilibrium Green's function formalisms within a unified framework called the contour formalism. The physical content of the contour Green's functions and the diagrammatic expansions are explained with a focus on the time-dependent aspect. Every result is derived step-by-step, critically discussed and then applied to different physical systems, ranging from molecules and nanostructures to metals and insulators. With an abundance of illustrative examples, this accessible book is ideal for graduate students and researchers who are interested in excited state properties of matter and nonequilibrium physics.
This is the first of a series of papers which describe the functional-integral approach to the study of the statistical and kinetic properties of nonequilibrium quantum fields in flat and curved spacetimes. In this paper we treat a system of self-interacting bosons described by \ensuremath{\lambda}${\ensuremath{\varphi}}^{4}$ scalar fields in flat space. We adopt the closed-time-path (CTP or ``in-in'') functional formalism and use a two-particle irreducible (2PI) representation for the effective action. These formalisms allow for a full account of the dynamics of quantum fields, and put the correlation functions on an equal footing with the mean fields. By assuming a thermal distribution we recover the real-time finite-temperature theory as a special case. By requiring the CTP effective action to be stationary with respect to variations of the correlation functions we obtain an infinite set of coupled equations which is the quantum-field-theoretical generalization of the Bogoliubov-Born-Green-Kirkwood-Yvon (BBGKY) hierarchy. Truncation of this series leads to dissipative characteristics in the subsystem. In this context we discuss the nature of dissipation in interacting quantum fields.To one-loop order in a perturbative expansion of the CTP effective action, the 2PI formalism yields results equivalent to the leading 1/N expansion for an O(N)-symmetric scalar field. To higher-loop order we introduce a two-time approximation to separate the quantum-field effects of radiative correction and renormalization from the statistical-kinetic effects of collisions and relaxation. In the weak-coupling quasiuniform limit, the system of nonequilibrium quantum fields can subscribe to a kinetic theory description wherein the propagators are represented in terms of relativistic Wigner distribution functions. From a two-loop calculation we derive the Boltzmann equation for the distribution function and the gap equation for the effective mass of the quasiparticles. One can define an entropy function for the quantum gas of quasiparticles which satisfies the H theorem. We also calculate the limits to the validity of the binary collision approximation from a three-loop analysis. The theoretical framework established here can be generalized to nonconstant background fields and for curved spacetimes.
In Chapter 3, we introduced a simple but reasonable approximation for the nonequilibrium dynamics of a Bose-condensed gas based on a generalized GP equation coupled to a kinetic equation. In Chapters 4–7, we turn to the question of how to derive such coupled equations for the condensate and noncondensate components in a way that gives a deeper understanding of the ZNG theory. Chapters 4–7 involve an introduction to Green's functions and field theoretic techniques for nonequilibrium problems. These provide the natural language and formalism to deal with the many subtle aspects of a Bose-condensed gas at finite temperatures. These four chapters are fairly technical. This chapter is mainly based on Kadanoff and Baym (1962) and Imamović-Tomasović (2001). Readers who are not interested in these questions can go straight to Chapter 8, which begins the discussion of applications of the ZNG coupled equations given in Chapter 3. Overview of Green's function approach To derive a microscopic theory of the nonequilibrium behaviour of a dilute weakly interacting Bose-condensed gas at finite temperatures, there are several different approaches available in the literature. We will use the wellknown Kadanoff–Baym (KB) nonequilibrium Green's function method. The generalization of this formalism to a Bose-condensed system was first considered by Kane and Kadanoff (1965), whose goal was to derive the Landau two-fluid hydrodynamic equations for a system with a Bose broken symmetry. The general problem consists of how to calculate the nonequilibrium response of a system induced by an external (space- and time-dependent) perturbation. In response to such an external perturbation, many interesting physical phenomena appear, including the excitation of collective modes and various transport processes.
We present a unified framework for equilibrium and nonequilibrium many-body perturbation theory. The most general nonequilibrium many-body theory valid for general initial states is based on a time-contour originally introduced by Konstantinov and Perel'. The various other well-known formalisms of Keldysh, Matsubara and the zero-temperature formalism are then derived as special cases that arise under different assumptions. We further present a single simple proof of Wick's theorem that is at the same time valid in all these flavors of many-body theory. It arises simply as a solution of the equations of the Martin-Schwinger hierarchy for the noninteracting many-particle Green's function with appropriate boundary conditions. We further discuss a generalized Wick theorem for general initial states on the Keldysh contour and derive how the formalisms based on the Keldysh and Konstantinov-Perel'-contours are related for the case of general initial states.