Excess entropy production in quantum systems

Tatsuro Yuge, Takahiro Sagawa, Ayumu Sugita +1 more

Satoshi Nakajima, 康弘 都倉

Phillip C. Lotshaw, Michael E. Kellman

We explore a recently introduced quantum thermodynamic entropy $S^Q_{univ}$ of a pure state of a composite system-environment computational "universe" with a simple system $\mathcal{S}$ coupled to a constant temperature bath $\mathcal{E}$. The principal focus is "excess entropy production" in which the quantum entropy change is greater than expected from the classical entropy-free energy relationship. We analyze this in terms of quantum spreading of time dependent states, and its interplay with the idea of a microcanonical shell. The entropy takes a basis-dependent Shannon information definition. We argue for the zero-order $\mathcal{SE}$ energy basis as the unique choice that gives classical thermodynamic relations in the limit of weak coupling and high density of states, including an exact division into system and environment components. Entropy production takes place due to two kinds of processes. The first is classical "ergodization" that fills the full density of states within the microcanonical shell. The second is excess entropy production related to quantum spreading or "quantum ergodization" of the wavepacket that effectively increases the width of the energy shell. Lorentzian superpositions with finite microcanonical shell width lead to classical results as the limiting case, with no excess entropy. We then consider a single $\mathcal{SE}$ zero-order initial state, as the examplar of extreme excess entropy production. Systematic formal results are obtained for a unified treatment of excess entropy production for time-dependent Lorentzian superpositions, and verified computationally. It is speculated that the idea of free energy might be extended to a notion of "available energy" corresponding to the excess entropy production. A unified perspective on quantum thermodynamic entropy is thereby attained from the classical limit to extreme quantum conditions.

Lorenzo Pucci, Massimiliano Esposito, Luca Peliti

Phillip C. Lotshaw, Michael E. Kellman

A recent proposal for a quantum entropy S univ Q for a pure state of a system-environment “universe” is developed to encompass a much more realistic temperature bath. Microcanonical entropy is formulated in the context of the idea of a quantum microcanonical shell. The fundamental relation that holds for the classical microcanonical ensemble − T Δ S univ = Δ F sys is tested for the quantum entropy Δ S univ Q in numerical simulations. It is found that there is “excess entropy production” Δ S x due to quantum time-energy uncertainty and spreading of states in the zero-order basis. The excess entropy production is found numerically to become small as the magnitude of the system-environment coupling nears zero, as one would hope for in the limit of the classical microcanonical ensemble. The quantum microcanonical ensemble and the new “universe entropy” thereby appear as well-founded concepts poised to serve as a point of departure for time-dependent processes in which excess entropy production is physically significant.

Kohei Yoshimura, Yoh Maekawa, Ryuna Nagayama +1 more

Thermodynamic force and irreversible current are the foundational concepts of classical nonequilibrium thermodynamics. Entropy production rate is provided by their product in classical systems, ranging from mesoscopic to macroscopic systems. However, there is no complete quantum extension of such a structure that respects quantum mechanics. In this paper, we propose anti-Hermitian operators that represent currents and forces accompanied by a gradient structure in open quantum systems described by the quantum master equation. We prove that the entropy production rate is given by the product of the force and current operators, which extends the canonical expression of the entropy production rate in the classical systems. The framework constitutes a comprehensive analogy with the nonequilibrium thermodynamics of discrete classical systems. We also show that the structure leads to the extensions of some results in stochastic thermodynamics: the geometric housekeeping-excess decomposition of entropy production and thermodynamic trade-off relations such as the thermodynamic uncertainty relation and the dissipation-time uncertainty relation. In discussing the trade-off relations, we will introduce a measure of fluctuation, which we term the quantum diffusivity.