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arXiv:1406.6527 · Physical Review E

Entropy for quantum pure states and quantum H theorem

Xizhi Han, Biao Wu

Published Jun 5, 2015• 23 citations
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Abstract

We construct a complete set of Wannier functions that are localized at both given positions and momenta. This allows us to introduce the quantum phase space, onto which a quantum pure state can be mapped unitarily. Using its probability distribution in quantum phase space, we define an entropy for a quantum pure state. We prove an inequality regarding the long-time behavior of our entropy's fluctuation. For a typical initial state, this inequality indicates that our entropy can relax dynamically to a maximized value and stay there most of time with small fluctuations. This result echoes the quantum H theorem proved by von Neumann [Zeitschrift für Physik 57, 30 (1929)]. Our entropy is different from the standard von Neumann entropy, which is always zero for quantum pure states. According to our definition, a system always has bigger entropy than its subsystem even when the system is described by a pure state. As the construction of the Wannier basis can be implemented numerically, the dynamical evolution of our entropy is illustrated with an example.

DOI
10.1103/physreve.91.062106

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We construct a complete set of Wannier functions that are localized at both given positions and momenta. This allows us to introduce the quantum phase space, onto which a quantum pure state can be mapped unitarily. Using its probability distribution in quantum phase space, we define an entropy for a quantum pure state. We prove an inequality regarding the long-time behavior of our entropy's fluctuation. For a typical initial state, this inequality indicates that our entropy can relax dynamically to a maximized value and stay there most of time with small fluctuations. This result echoes the quantum H theorem proved by von Neumann [Zeitschrift für Physik 57, 30 (1929)]. Our entropy is different from the standard von Neumann entropy, which is always zero for quantum pure states. According to our definition, a system always has bigger entropy than its subsystem even when the system is described by a pure state. As the construction of the Wannier basis can be implemented numerically, the dynamical evolution of our entropy is illustrated with an example.
We propose a generalization of the quantum entropy introduced by Wigner and von Neumann [Z. Phys. 57, 30 (1929)10.1007/BF01339852]. Our generalization is applicable to both quantum pure states and mixed states. When the dimension N of the Hilbert space is large, this generalized Wigner-von Neumann (GWvN) entropy becomes independent of the choices of basis and is asymptotically equal to lnN in the sense of typicality. The dynamic evolution of our entropy is also typical, and is reminiscent of quantum H theorem proved by von Neumann. For a composite system, the GWvN entropy is typically additive; for the microcanonical ensemble, it is equivalent to the Boltzmann entropy; and for a system entangled with environment, it is consistent with the familiar von Neumann entropy, which is zero for pure states. In addition, the GWvN entropy can be used to derive the Gibbs ensemble.
We investigate quantum dynamical systems defined on a finite dimensional Hilbert space and subjected to an interaction with an environment. The rate of decoherence of initially pure states, measured by the increase of their von Neumann entropy, averaged over an ensemble of random pure states, is proved to be bounded from above by the partial entropy used to define the ALF dynamical entropy. The rate of decoherence induced by the sequence of the von Neumann projectors measurements is shown to be maximal, if the measurements are performed in a randomly chosen basis. The numerically observed linear increase of entropies is attributed to free-independence of the measured observable and the unitary dynamical map.
Our point of departure are the unitary dynamics of closed quantum systems as generated from the Schrödinger equation. We focus on a class of quantum models that typically exhibit roughly exponential relaxation of some observable within this framework. Furthermore, we focus on pure state evolutions. An entropy in accord with Jaynes principle is defined on the basis of the quantum expectation value of the above observable. It is demonstrated that the resulting deterministic entropy dynamics are in a sense in accord with a transient fluctuation theorem. Moreover, we demonstrate that the dynamics of the expectation value are describable in terms of an Ornstein-Uhlenbeck process. These findings are demonstrated numerically and supported by analytical considerations based on quantum typicality.
This article provides a concise review of quantum phase space theory, beginning with its foundational principles and the properties of standard quantum quasi-probability distributions, specifically the Wigner, Husimi Q, and Glauber--Sudarshan P functions. We discuss the intrinsic limitations of these distributions, such as the appearance of negative values and phase-space blurring. A significant portion of this review highlights recent theoretical developments, particularly the quantum Wannier basis. This approach establishes a unitary mapping between the Hilbert space and a discretized phase space, yielding a genuine probability distribution in phase space and thereby providing a basis-dependent entropy for pure quantum states. Furthermore, we examine Bourgain's nonperiodic basis as a theoretical framework to circumvent the constraints imposed by the Balian--Low theorem. These developments provide practical tools for numerical studies based on the quantum Wannier basis, as well as conceptual benchmarks for understanding the localization limits of orthonormal phase-space representations.
Given the algebra of observables of a quantum system subject to selection rules, a state can be represented by different density matrices. As a result, different von Neumann entropies can be associated with the same state. Motivated by a minimality property of the von Neumann entropy of a density matrix with respect to its possible decompositions into pure states, we give a purely algebraic definition of entropy for states of an algebra of observables, thus solving the above ambiguity. The entropy so-defined satisfies all the desirable thermodynamic properties and reduces to the von Neumann entropy in the quantum mechanical case. Moreover, it can be shown to be equal to the von Neumann entropy of the unique representative density matrix belonging to the operator algebra of a multiplicity-free Hilbert-space representation.
The quantum entropy is usually defined using von Neumann's formula, which measures lack of information and vanishes for pure states. In contrast, we obtain a formula for the entropy of a pure state as it is measured from thermodynamic experiments, solely from the self-entanglement of the wave function, and find strong numerical evidence that the two are in agreement for nonintegrable systems, both for energy eigenstates and for states that are obtained at long times under the evolution of more general initial conditions. This is an extension of Boltzmann's hypothesis for classical systems, relating microscopic motion to thermodynamics.