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Journal of the Physical Society of Japan

A Mechanism of the Increase of Entropy in an Isolated Macroscopic System

Yoshihiro Nakato

Published Jan 8, 2021• 1 citation
Publisher

Abstract

The law of increase of entropy is one of the most important laws in science but no exact explanation has been given to the origin of it. Statistical thermodynamics only explains it by using Boltzmann’s statistical interpretation together with not sufficiently verified assumptions. This paper shows that the increase of entropy in an isolated macroscopic system can be reasonably explained with no assumption based on quantum mechanics if we take into account that microscopic particles such as electrons and atomic nuclei not only move in space but also have the basic quality of spontaneously spreading into every possible spatial position. The present work allows us to give a plausible definition to the entropy of an isolated system by using the Hamiltonian operator and a wave function of it and provides a firm basis for thermodynamics. It also gives a new physical meaning of entropy effective for further studies of irreversible processes in nature.

DOI
10.7566/jpsj.90.024003

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The law of increase of entropy is one of the most important laws in science but no exact explanation has been given to the origin of it. Statistical thermodynamics only explains it by using Boltzmann’s statistical interpretation together with not sufficiently verified assumptions. This paper shows that the increase of entropy in an isolated macroscopic system can be reasonably explained with no assumption based on quantum mechanics if we take into account that microscopic particles such as electrons and atomic nuclei not only move in space but also have the basic quality of spontaneously spreading into every possible spatial position. The present work allows us to give a plausible definition to the entropy of an isolated system by using the Hamiltonian operator and a wave function of it and provides a firm basis for thermodynamics. It also gives a new physical meaning of entropy effective for further studies of irreversible processes in nature.
The irreversible entropy increase described by the second law of thermodynamics is fundamentally tied to thermalization and the emergence of equilibrium. In the first part of our work (Ref: arXiv.2503.04152), we constructed an isolated gas system model and numerically demonstrated irreversible growth of entanglement entropy caused by erasure of spread non-equilibrium state information. Here, we mathematically prove that for a typical macroscopic system in a non-equilibrium state ∣ϕ0⟩|ϕ_0\rangle∣ϕ0​⟩, the quantum state ∣ϕ0′⟩=O^(t)∣ϕ0⟩|ϕ'_0\rangle = \hat{O}(t)|ϕ_0\rangle∣ϕ0′​⟩=O^(t)∣ϕ0​⟩ will inevitably evolve toward equilibrium. Our work demonstrates that the second law of thermodynamics, and consequently the ergodic hypothesis in statistical physics, can be understood and proven from a quantum information perspective. From this perspective, the second law can be stated as: In typical macroscopic physical systems, the spreading and erasure of non-equilibrium information is inevitable.
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The problem of time’s arrow is (roughly) to understand why macroscopic physical processes typically evolve in a specific direction (the one we call “the future”) even though the underlying laws of physics describing the individual microscopic systems are time-reversal invariant. The standard answer to this problem is given by Boltzmann’s explanation of the II law of thermodynamics: a classical system starting in a non-equilibrium state spontaneously (i.e. with a high level of probability) tends towards equilibrium, thus implementing an irreversible process. However, this explanation has two drawbacks: 1. it needs a further assumption on the entropy of the initial state of the universe (past hypothesis); 2. microscopic systems (e.g. molecules in a box) should be represented as quantum states and not classical states. In this talk, I want to propose a different hypothesis to explain the origin of time’s arrow, based on quantum mechanics, specifically on decoherence theory. Differently from isolated systems, open quantum systems described by decoherence theory showirreversible behavior, as they evolve towards decoherence and von Neumann entropy increase. Is this behavior a sign of genuine irreversibility? And, if so, can this be linked to thermodynamic irreversibility?
Irreversible processes are frequently adopted to account for the entropy increase in classical thermodynamics. However, the corresponding physical origins are not always clear, e.g. in a free expansion process, a typical model in textbooks. In this letter, we study the entropy change during free expansion for a particle with the thermal de Broglie wavelength (λTλ_{T}λT​) in a one-dimensional square trap with size LLL. By solely including quantum dephasing as an irreversible process, we recover classical result of entropy increase in the classical region (L≫λTL\ggλ_{T}L≫λT​), while predict prominent discrepancies in the quantum region (L≪λTL\llλ_{T}L≪λT​) because of non-equilibrium feature of trapped atoms after expansion. It is interesting to notice that the dephasing, though absent in classical system, is critical to clarify mysteries in classical thermodynamics.
The second law of thermodynamics states that the entropy of an isolated system can only increase over time. This appears to conflict with the reversible evolution of isolated quantum systems under the Schrödinger equation, which preserves the von Neumann entropy. Nonetheless, one finds that with respect to many observables, expectation values approach a fixed value—their equilibrium value. This ultimately raises the question: ? For classical systems, one introduces the assumption of a low-entropy initial state along with the concept of ignorance about the microscopic details of the physical system, leading to a statistical interpretation of the second law. By considering the observables through which we examine quantum systems, both these assumptions can be incorporated, building upon recent studies of the of observables. While the statistical behavior of observable expectation values is well established, a quantitative connection to entropy increase has been lacking so far. In deriving novel bounds for the equilibration of observables, and considering the entropy of the system relative to observables, we recover a variant of the second law: the entropy with respect to a given observable tends toward its equilibrium value in the course of the system’s unitary evolution. These results also support recent findings that question the necessity of nonintegrability for equilibration in quantum systems. We further illustrate our bounds using numerical results from the paradigmatic example of a quantum Ising model on a chain of spins. There, we observe entropy increasing up to equilibrium values, as well as fluctuations, which expose the underlying reversible evolution in accordance with the derived bounds.
Deriving the laws of thermodynamics from a microscopic picture is a central quest of statistical mechanics.This tutorial focuses on the derivation of the first and second law for isolated and open quantum systems far from equilibrium, where such foundational questions also become practically relevant for emergent nanotechnologies.The derivation is based on a microscopic definition of five essential quantities: internal energy, thermodynamic entropy, work, heat, and temperature.These definitions are shown to satisfy the phenomenological laws of nonequilibrium thermodynamics for a large class of states and processes.The consistency with previous results is demonstrated.The framework applies to multiple baths including particle transport and accounts for processes with, e.g., a changing temperature of the bath, which is determined microscopically.An integral fluctuation theorem for entropy production is satisfied.In summary, this tutorial introduces a consistent and versatile framework to understand and apply the laws of thermodynamics in the quantum regime and beyond.