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arXiv:2503.08567

Density matrices in quantum field theory: Non-Markovianity, path integrals and master equations

Christian Käding, Mario Pitschmann

Published Mar 11, 2025• 1 citation
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Abstract

Density matrices are powerful mathematical tools for the description of closed and open quantum systems. Recently, methods for the direct computation of density matrix elements in scalar quantum field theory were developed based on thermo field dynamics (TFD) and the Schwinger-Keldysh formalism. In this article, we provide a more detailed discussion of these methods and derive expressions for density matrix elements of closed and open systems. At first, we look at closed systems by discussing general solutions to the Schrödinger-like form of the quantum Liouville equations in TFD, showing that the dynamical map is indeed divisible, deriving a path integral-based expression for the density matrix elements in Fock space, and explaining why perturbation theory enables us to use the last even in situations where all initial states in Fock space are occupied. Subsequently, we discuss open systems in the same manner after tracing out environmental degrees of freedom from the solutions for closed systems. We find that, even in a general basis, the dynamical map is not divisible, which renders the dynamics of open systems non-Markovian. Finally, we show how the resulting expressions for open systems can be used to obtain quantum master equations, and comment on the artificiality of time integrals over density matrices that usually appear in many other master equations in the literature but are absent in ours.

DOI
10.48550/arxiv.2503.08567

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Density matrices are powerful mathematical tools for the description of closed and open quantum systems. Recently, methods for the direct computation of density matrix elements in scalar quantum field theory were developed based on thermo field dynamics (TFD) and the Schwinger-Keldysh formalism. In this article, we provide a more detailed discussion of these methods and derive expressions for density matrix elements of closed and open systems. At first, we look at closed systems by discussing general solutions to the Schrödinger-like form of the quantum Liouville equations in TFD, showing that the dynamical map is indeed divisible, deriving a path integral-based expression for the density matrix elements in Fock space, and explaining why perturbation theory enables us to use the last even in situations where all initial states in Fock space are occupied. Subsequently, we discuss open systems in the same manner after tracing out environmental degrees of freedom from the solutions for closed systems. We find that, even in a general basis, the dynamical map is not divisible, which renders the dynamics of open systems non-Markovian. Finally, we show how the resulting expressions for open systems can be used to obtain quantum master equations, and comment on the artificiality of time integrals over density matrices that usually appear in many other master equations in the literature but are absent in ours.
We demonstrate the power of a first principle-based and practicable method that allows for the perturbative computation of reduced density matrix elements of an open quantum system without making use of any master equations. The approach is based on techniques from nonequilibrium quantum field theory such as thermo field dynamics, the Schwinger-Keldsyh formalism, and the Feynman-Vernon influence functional. It does not require the Markov approximation and is essentially a Lehmann-Szymanzik-Zimmermann-like reduction. To illustrate this method, we consider a real scalar field as an open quantum system interacting with an environment comprising another real scalar field. We give a general formula that allows for the perturbative computation of density matrix elements for any number of particles in a momentum basis. Finally, we consider a simple toy model and use this formula to obtain expressions for some of the system's reduced density matrix elements.
We provide a description of interacting quantum fields in terms of density matrices for any occupation numbers in Fock space in a momentum basis. As a simple example, we focus on a real scalar field interacting with another real scalar field, and present a practicable formalism for directly computing the density matrix elements of the combined scalar–scalar system. For deriving the main formula, we use techniques from non-equilibrium quantum field theory like thermo-field dynamics and the Schwinger–Keldysh formalism. Our results allow for studies of particle creation/annihilation processes at finite times and other non-equilibrium processes, including those found in the theory of open quantum systems.
We develop a systematic field-theoretical approach to open quantum systems based on condensed-matter many-body methods. The time evolution of the reduced density matrix for the open quantum system is determined by a transmission matrix. Developing diagrammatic perturbation theory, invoking Wick's theorem in connection with a Caldeira-Leggett quantum oscillator environment in thermal equilibrium, the transmission matrix satisfies a Dyson equation characterized by an irreducible kernel. Unlike the Nakajima-Zwanzig and standard approaches, the Dyson equation is equivalent to a general non-Markovian master equation for the reduced density matrix, incorporating secular effects and independent of the initial preparation. The kernel is determined by a systematic diagrammatic expansion in powers of the interaction. We consider the Born approximation for the kernel. Applying a condensed-matter pole or, equivalently, a quasiparticle-type approximation, equivalent to the usual assumption of a timescale separation, we derive a master equation of the Markov type. Furthermore, imposing the rotating-wave approximation, we obtain a Markov master equation of the Lindblad form. To illustrate the method, we consider the standard example of a single qubit coupled to a thermal heat bath.
A bstract In this paper, we investigate the general formalism and properties of the spacetime density matrix, which captures correlations among different Cauchy surfaces and can be regarded as a natural generalization of the standard density matrix defined on a single Cauchy surface. We present the construction of the spacetime density matrix in general quantum systems and its representation via the Schwinger-Keldysh path integral. We further introduce a super-operator framework, within which the spacetime density matrix appears as a special case, and discuss possible generalizations from this perspective. We also show that the spacetime density matrix satisfies a Liouville-von Neumann type equation of motion. When considering subsystems, a reduced spacetime density matrix can be defined by tracing over complementary degrees of freedom. We study the general properties of its moments and, in particular, derive universal short-time behavior of the second moment. We find that coupling between subsystems plays a crucial role in obtaining nontrivial results. Assuming weak coupling, we develop a perturbative method to compute the moments systematically.
Time-dependent [current]-density functional theory for open quantum systems (OQS) has emerged as a formalism that can incorporate dissipative effects in the dynamics of many-body quantum systems. Here, we review and clarify some formal aspects of these theories that have been recently questioned in the literature. In particular, we provide theoretical support for the following conclusions: (1) contrary to what we and others had stated before, within the master equation framework, there is in fact a one-to-one mapping between vector potentials and current densities for fixed initial state, particle-particle interaction, and memory kernel; (2) regardless of the first conclusion, all of our recently suggested Kohn-Sham (KS) schemes to reproduce the current and particle densities of the original OQS, and in particular, the use of a KS closed driven system, remains formally valid; (3) the Lindblad master equation maintains the positivity of the density matrix regardless of the time-dependence of the Hamiltonian or the dissipation operators; (4) within the stochastic Schrödinger equation picture, a one-to-one mapping from stochastic vector potential to stochastic current density for individual trajectories has not been proven so far, except in the case where the vector potential is the same for every member of the ensemble, in which case, it reduces to the Lindblad master equation picture; (5) master equations may violate certain desired properties of the density matrix, such as positivity, but they remain as one of the most useful constructs to study OQS when the environment is not easily incorporated explicitly in the calculation. The conclusions support our previous work as formally rigorous, offer new insights into it, and provide a common ground to discuss related theories.
Abstract This chapter introduces the density operator and the Liouville equation and outlines how reduced dynamical description of open quantum systems naturally leads to the appearance of relaxation processes. (1) The density operator and the quantum Liouville equation (the density matrix for a pure system, statistical mixtures, representations, coherences, thermodynamic equilibrium). (2) An example: The time evolution of a two-level system in the density matrix formalism. (3) Reduced descriptions. (4) Time evolution equations for reduced density operators: The quantum master equation (projection operators, The Nakajima–Zwanzig equation, Derivation of the quantum master equation using the thermal projector, The quantum master equation in the interaction representation, The Markovian limit—the Redfield equation, The secular approximation and the Lindblad equation). (5) The Lindblad equation in the ‘Heisenberg representation’. (6) Relaxation of a two-level system and a harmonic oscillator revisited. (7) The optically driven two-level system in a thermal environment—the Bloch equations. (8) The oscillating dipole model of a two-level molecule. (9) Analogy of a coupled two-level system to a spin ½ system in a magnetic field.