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arXiv:1602.04037 · Journal of Modern Optics

Using thermodynamics to identify quantum subsystems

Adam Stokes, Prasenjit Deb, Almut Beige

Published Mar 10, 2017• 11 citations
arXivHTMLPDF

Abstract

There are many ways to decompose the Hilbert space H of a composite quantum system into tensor product subspaces. Different subsystem decompositions generally imply different interaction Hamiltonians V, and therefore different expectation values for subsystem observables. This means that the uniqueness of physical predictions is not guaranteed, despite the uniqueness of the total Hamiltonian H and the total Hilbert space H. Here we use Clausius’ version of the second law of thermodynamics (CSL) and standard identifications of thermodynamic quantities to identify possible subsystem decompositions. It is shown that agreement with the CSL is obtained, whenever the total Hamiltonian and the subsystem-dependent interaction Hamiltonian commute (i.e. [H,V]=0). Not imposing this constraint can result in the transfer of heat from a cooler to a hotter subsystem, in conflict with thermodynamics. We also investigate the status of the CSL with respect to non-standard definitions of thermodynamic quantities and quantum subsystems.

DOI
10.1080/09500340.2017.1295108

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There are many ways to decompose the Hilbert space H of a composite quantum system into tensor product subspaces. Different subsystem decompositions generally imply different interaction Hamiltonians V, and therefore different expectation values for subsystem observables. This means that the uniqueness of physical predictions is not guaranteed, despite the uniqueness of the total Hamiltonian H and the total Hilbert space H. Here we use Clausius’ version of the second law of thermodynamics (CSL) and standard identifications of thermodynamic quantities to identify possible subsystem decompositions. It is shown that agreement with the CSL is obtained, whenever the total Hamiltonian and the subsystem-dependent interaction Hamiltonian commute (i.e. [H,V]=0). Not imposing this constraint can result in the transfer of heat from a cooler to a hotter subsystem, in conflict with thermodynamics. We also investigate the status of the CSL with respect to non-standard definitions of thermodynamic quantities and quantum subsystems.
Abstract Any Hilbert space with composite dimension can be represented as a tensor product of Hilbert spaces of lower dimensions. This factorization makes it possible to decompose a quantum system into subsystems. We propose a model based on finite quantum mechanics for the constructive study of decompositions of an isolated quantum system into subsystems. To study the behavior of the composite systems resulting from the decompositions, we develop algorithms based on methods of computer algebra and computational group theory.
Two approaches to describing the thermodynamics of a subsystem that interacts with a thermal bath are considered. Within the first approach, the mean system energy E_{S} is identified with the expectation value of the system Hamiltonian, which is evaluated with respect to the overall (system+bath) equilibrium distribution. Within the second approach, the system partition function Z_{S} is considered as the fundamental quantity, which is postulated to be the ratio of the overall (system+bath) and the bath partition functions, and the standard thermodynamic relation E_{S}=-d(ln Z_{S})/dbeta is used to obtain the mean system energy. Employing both classical and quantum-mechanical treatments, the advantages and shortcomings of the two approaches are analyzed in detail for various different systems. It is shown that already within classical mechanics both approaches predict significantly different results for thermodynamic quantities provided the system-bath interaction is not bilinear or the system of interest consists of more than a single particle. Based on the results, it is concluded that the first approach is superior.
A consistent theory of non-equilibrium thermodynamics for Markovian open quantum systems has been developed in the late seventies in analogy with Classical Irreversible Thermodynamics. The time-evolution of these open systems is usually described by means of effective master equations in Lindblad form, that turn out to be reliable when there is a separation of time-scales between system and environment, such that memory effects are negligible and the so-called Markovian approximation is justified. In this framework, the variations of energy and entropy in the system are consistently described, distinguishing between heat and work contributions and providing a statement of the second law of thermodynamics as positivity of the entropy production.\nHowever, there is empirical evidence that many physical systems like photosynthetic complexes,\nopto-mechanical resonators and superconducting qubits, just to mention a few, experience more general non-Markovian dynamics. The formulation of the laws of thermodynamics in a non-Markovian setting is matter of current research and represents the main topic of the present work. As a first step, we show that the entropy production defined as in the Markovian case can be negative for a class of non-Markovian dynamics. We argue that this outcome should not be interpreted as a violation of the second law of thermodynamics because the environment must be explicitly taken into account in the balance of entropy in the non-Markovian setting. In order to justify this claim we adopt a more general point of view, studying a closed bipartite quantum system, such that each of the two subsystems plays the role of a finite environment out of equilibrium for the other one. We concentrate on the balance of energy first and construct an effective Hamiltonian for each subsystem using physically reasonable requirements; then we define heat and work as in the standard Markovian treatment, with the effective Hamiltonian replacing the free Hamiltonian. It turns out that, in our framework, the work power is perfectly balanced between subsystems, while the correlations can store a part of energy locally inaccessible and exchange it with both subsystems in the form of heat.\nConcerning the balance of entropy, a quite general formulation of the second law of thermodynamics can be given as follows: under the assumption of a factorized initial state for the compound system, the sum of the total variations of the entropies in the two subsystems is always nonnegative. We show with an explicit example that this general formulation does not correspond to the statement presented in the framework of Markovian master equations, which should not be considered a priori the second law of thermodynamics.\nIn the last part of the thesis we concentrate of the so-called fluctuation relations, that are results extending the thermodynamic formalism beyond the behavior of average quantities. After reviewing the main theoretical outcomes, such as the Jarzynski equality and the Crooks fluctuation theorem, we describe a proposal to access experimentally the work performed on an ensemble of diatomic molecules by a time-dependent electric field coupled with their vibrational degree of freedom. This procedure could then be used to test the quantum Jarzynski equality. With respect to the results so far appeared in the literature, in which the left-hand side of the equality is inferred from an experiment and the right-hand side is computed according to a model, in our proposed setting we should be able to estimate from the experiment both the left-hand side and the right-hand side of the equality, independently.
We reinterpret the microcanonical conditions in the quantum domain as constraints for the interaction of the "gas subsystem" under consideration and its environment ("container"). The time average of a purity measure is found to equal the average over the respective path in Hilbert space. We then show that for typical (degenerate or nondegenerate) thermodynamical systems almost all states within the allowed region of Hilbert space have a local von Neumann entropy S close to the maximum and a purity P close to its minimum, respectively. Typically, thermodynamical systems should obey the second law.
This paper investigates the relationship between subsystems and time in a closed nonrelativistic system of interacting bosons and fermions. It is possible to write any state vector in such a system as an unentangled tensor product of subsystem vectors, and to do so in infinitely many ways. This requires the superposition of different numbers of particles, but the theory can describe in full the equivalence relation that leads to a particle-number superselection rule in conventionally defined subsystems. Time is defined as a functional of subsystem changes, thus eliminating the need for any reference to an external time variable. The dynamics of the unentangled subsystem decomposition is derived from a variational principle of dynamical stability, which requires the decomposition to change as little as possible in any given infinitesimal time interval, subject to the constraint that the state of the total system satisfy the Schroedinger equation. The resulting subsystem dynamics is deterministic. This determinism is regarded as a conceptual tool that observers can use to make inferences about the outside world, not as a law of nature. The experiences of each observer define some properties of that observer's subsystem during an infinitesimal interval of time (i.e., the present moment); everything else must be inferred from this information. The overall structure of the theory has some features in common with quantum Bayesianism, the Everett interpretation, and dynamical reduction models, but it differs significantly from all of these. The theory of information described here is largely qualitative, as the most important equations have not yet been solved. The quantitative level of agreement between theory and experiment thus remains an open question.