- School of Science, Dalian Maritime University, Dalian, China
Based on the quantum Liouville and Lindblad equations, a temperature-dependent pure state was constructed for the composite isolated system consisting of a thermodynamic system and its heat reservoir. The results demonstrate that the expectation value of this pure state coincides with the statistical average of the thermodynamic system’s mixed state. Furthermore, the existence of this pure state is consistent with the eigenstate thermalization hypothesis. Additionally, the “fictitious system” introduced in thermo field dynamics can be naturally interpreted as the heat reservoir of the system, and this interpretation allows us to re-examine the relationship between the physical system and the so-called “fictitious system.”
1 Introduction
Finite-temperature field theory (FTFT), also known as thermal field theory, serves as the relativistic generalization of finite-temperature non-relativistic quantum statistical mechanics. It extends the methods of zero-temperature quantum field theory to finite-temperature conditions, providing a powerful framework for studying thermal phenomena in extreme regimes of temperature and density [1]. FTFT is typically categorized into two formalisms: the imaginary-time formalism, which exhibits a characteristic imaginary-time periodicity, and the real-time formalism, distinguished by its doubled degrees of freedom [2]. The idea of doubled degrees of freedom has been applied in many areas, including quantum field theory for non-conservative systems [3], quantum entanglement phenomena [4], holographic systems [5], and the dynamics of driven many-body quantum systems at finite temperature [6], among others. However, the physical interpretation of the doubled degrees of freedom has long been debated without reaching a broad consensus.
As a real-time formulation of finite-temperature quantum field theory, thermo field dynamics (TFD) enable the application of Feynman diagram techniques to real-time causal Green’s functions at finite temperatures [7], thereby determining the thermodynamic properties of the system. Although numerous interpretations have been proposed regarding the physical meaning of the doubled degrees of freedom in TFD [7–11], we argue that many of these explanations remain largely speculative, lacking grounding in fundamental physical principles.
In this work, we first briefly review the dynamics of isolated and open quantum systems. We emphasize that an isolated system governed by the quantum Liouville equation does not undergo global thermalization, whereas an open system obeying the Lindblad equation eventually thermalizes through interaction with a heat reservoir. Subsequently, we construct a temperature-dependent pure state for a composite isolated system comprising a thermodynamic system and its heat reservoir. The expectation value of this pure state aligns with the statistical average of the thermodynamic system’s mixed state. Furthermore, we analyze the compatibility of this temperature-dependent pure state with the eigenstate thermalization hypothesis (ETH), propose a physical interpretation of the “fictitious system” in TFD, and clarify the historical ambiguity in its interpretation. Finally, we examine the structural features of the temperature-dependent pure state and explain why such characteristics are suitable for calculating thermodynamic quantities using methods in quantum field theory.
2 Construction of the temperature-dependent pure state
2.1 Dynamics of an isolated quantum system
The state vector
where
where
where the coefficient
where
It is evident that a generic pure state cannot exhibit the thermal equilibrium behavior. The time-independent diagonal terms depend on the initial state’s coefficients, while the off-diagonal terms exhibit harmonic time dependence that generally does not decay to 0. On the other hand, the thermodynamic entropy of a system (commonly referred to as Boltzmann or Gibbs entropy in statistical physics) vanishes for a pure state but is positive for a mixed state. From the perspective of quantum mechanics, all thermodynamic systems—including so-called isolated systems—are effectively open and must be described by mixed states, thus possessing positive thermodynamic entropy [13]. However, an isolated quantum system undergoing unitary evolution remains in a time-dependent pure state, implying that its global thermodynamic entropy is rigorously 0. This observation reinforces the conclusion that a genuinely isolated system cannot thermalize globally. Nevertheless, as discussed in Section 3.1, a subsystem of such an isolated system can undergo thermalization by treating the remainder as an effective heat reservoir at fixed energy [14].
2.2 Dynamics of an open quantum system
When an isolated system interacts with an external environment, it becomes an open system. Due to the entanglement between the system and its environment, the system’s evolution becomes non-unitary, and its dynamics are governed by the quantum master equation. The combined system–environment pair
The total Hamiltonian
where “
Let
where
is also known as the reduced density matrix of
where
where
2.3 Thermalization of an open system coupled to a heat reservoir
Assume that the environment is in a stationary state; then,
is a stationary solution of the quantum master (Equation 5) [15]. This means that regardless of the initial state,
The abovementioned discussion indicates that the thermal equilibrium density matrix of
where
is the probability that the system is in the energy eigenstate
2.4 Constructing a temperature-dependent pure state for the composite isolated system
According to the quantum Liouville equation, the composite isolated system
where the coefficient
As established earlier, in the long-time limit,
where
It can be proven that the set
and it is the set of eigenstates of the following reduced density matrix for
It should be emphasized that if
Since the temperature parameter
The corresponding density matrix of the temperature-dependent pure state
It is easy to check that the reduced density of
As shown in Section 2.2, for an observable
In the energy representation,
In this way, a question in quantum field theory realized through a temperature-dependent pure state and a question in statistical mechanics concerning a subsystem in thermal equilibrium can be converted into each other.
3 Discussion
3.1 Heat reservoir as a subsystem in a composite isolated system
As demonstrated in Section 2.3, a system interacting with a heat reservoir will undergo thermalization in the long-time limit. However, this framework requires the heat reservoir to be predefined as part of a composite isolated system. It seems that this prior assumption introduces limitations in constructing
Recent studies, however, demonstrate that for an isolated system satisfying the ETH, its subsystem can indeed thermalize [19–22]. The ETH serves as the primary conceptual framework for understanding how quantum mechanics leads to thermalization. According to the ETH, each eigenstate of the Hamiltonian of the composite system
and the temperature parameter
where
The microscopic origin of temperature might still be considered an open question. Although the ETH has been widely validated as a sufficient condition for thermalization in many finite-sized systems through numerical simulations [14], it has not been universally proven to be a necessary condition. Due to the presence of local conserved quantities that prevent thermalization, there exist systems that do not thermalize at all, such as integrable systems or many-body localized states [25].
3.2 Physical interpretation of the “fictitious system” in TFD
As shown in Equation 12, the eigenstates
Equation 13 serves as the foundational starting point of TFD. Notably, in TFD, the density matrix
If
This reinterpretation of the “fictitious system” may prompt a re-examination of previously controversial or even meaningless questions. For instance, Takahashi et al. argued that a “one particle state” is built up from the thermal equilibrium state either by adding a particle to the physical system or eliminating a particle from the “fictitious system,” thereby interpreting a particle in the “fictitious system” as a “hole” of a physical particle. In our framework, however, this corresponds to the physical equivalence between annihilating a particle in the heat reservoir and creating a particle in the system.
As a further example, we can now analyze the quantum entanglement between the physical system and the so-called “fictitious system”—a question previously devoid of physical significance. The Schmidt number for the state
where
It is essential to clarify that for a composite isolated system consisting of two subsystems in thermal equilibrium, the vanishing thermodynamic entropy of the global pure state does not contradict the non-zero thermodynamic entropy of its subsystems. This arises because while the quantum information is preserved, it becomes hidden locally throughout the system and is only accessible through measurements of global observables that do not thermalize [16].
3.3 Characteristics of the component state in the temperature-dependent pure state
As an entangled state,
To illustrate the construction of such a state, consider a system of free bosons. Since the Hamiltonian commutes with the particle number operator, the density operator, Hamiltonian, and particle number operator share common eigenstates. Let
and the corresponding eigenvalues of the particle number operator, density operator, and Hamiltonian are
On introducing the eigenstates of the particle number operator of
Note that the identity operator in the Hilbert spaces of
which is the well-known Bose distribution.
It is important to note that for analytically solvable problems, the pure-state expectation value method does not inherently simplify thermodynamic calculations. However, for systems requiring approximate treatments, this formulation provides novel perspectives and techniques for studying finite-temperature phenomena through quantum field theory [1].
4 Conclusion
In this work, we construct a temperature-dependent pure state for the composite isolated system, comprising a thermodynamic system and its heat reservoir, grounded in the foundational principles of quantum mechanics. Our analysis demonstrates that this pure state aligns with the ETH. Specifically, the common eigenstates of a complete set of observables for the thermodynamic system—including the density matrix and Hamiltonian—appear in every product state of this pure state, and the same is true for analogous eigenstates of the heat reservoir. Notably, when the particle number operator commutes with the Hamiltonian, the component states within each product state of this temperature-dependent pure state correspond to Fock space basis vectors. This structure can significantly facilitate the calculation of thermodynamic quantities through the perturbative techniques in quantum field theory.
Based on the construction of the temperature-dependent pure state, we propose a physical interpretation of the “fictitious system” in TFD, identifying it as the heat reservoir coupled to the physical system. In an alternative real-time formalism of FTFT, the time-path method, the thermal Green’s function adopts a
Data availability statement
The original contributions presented in the study are included in the article/supplementary material; further inquiries can be directed to the corresponding author.
Author contributions
YG: writing – original draft. JZ: writing – original draft. DM: methodology and writing – review and editing. DW: writing – original draft.
Funding
The author(s) declare that financial support was received for the research and/or publication of this article. This work was supported by the Discipline Development Fund of Dalian Maritime University (Grant No. 36330626).
Acknowledgments
The authors would like to express their gratitude to Prof. Wu Biao for the valuable discussions, opinions, and suggestions.
Conflict of interest
The authors declare that the research was conducted in the absence of any commercial or financial relationships that could be construed as a potential conflict of interest.
Generative AI statement
The author(s) declare that no Generative AI was used in the creation of this manuscript.
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Keywords: composite isolated system, pure state, mixed state, expectation value, statistical average, thermo field dynamics
Citation: Guo YQ, Zhang JX, Mi D and Wang DF (2025) Temperature-dependent pure state for the thermodynamic system and its heat reservoir. Front. Phys. 13:1569310. doi: 10.3389/fphy.2025.1569310
Received: 31 January 2025; Accepted: 21 April 2025;
Published: 20 May 2025.
Edited by:
Xiangrong Wang, Hong Kong University of Science and Technology, Hong Kong SAR, ChinaReviewed by:
Antonio Sérgio Magalhães De Castro, Universidade Estadual de Ponta Grossa, BrazilGiovanni Modanese, Free University of Bozen-Bolzano, Italy
Copyright © 2025 Guo, Zhang, Mi and Wang. This is an open-access article distributed under the terms of the Creative Commons Attribution License (CC BY). The use, distribution or reproduction in other forums is permitted, provided the original author(s) and the copyright owner(s) are credited and that the original publication in this journal is cited, in accordance with accepted academic practice. No use, distribution or reproduction is permitted which does not comply with these terms.
*Correspondence: D. Mi, bWlkQGRsbXUuZWR1LmNu