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The Journal of Chemical Physics

A quantum-mechanical heat engine operating in finite time. A model consisting of spin-1/2 systems as the working fluid

Eitan Geva, Ronnie Kosloff

Published Feb 15, 1992• 334 citations
Publisher

Abstract

The finite-time operation of a quantum-mechanical heat engine with a working fluid consisting of many noninteracting spin-1/2 systems is considered. The engine is driven by an external, time-dependent and nonrotating magnetic field. The cycle of operation consists of two adiabats and two isotherms. The analysis is based on the time derivatives of the first and second laws of thermodynamics. Explicit relations linking quantum observables to thermodynamic quantities are developed. The irreversible operation of this engine is studied in three cases: (1) The sudden limit, where the performance is found to be the same as that of the spin analog of the Otto cycle. This case provides the lower bound of efficiency. (2) The step-cycle operation scheme. Here, the optimization of power is carried out in the high-temperature limit (the ‘‘classical’’ limit). The results obtained are similar to those of Andresen et al. [Phys. Rev. A 15, 2086 (1977)]. (3) The Curzon–Ahlborn operation scheme. The semigroup approach is used to model the dynamics. Then the power production is optimized. All the results obtained for Newtonian engines operating by the same scheme, such as the Curzon–Ahlborn efficiency, apply in the high-temperature limit. These results are obtained without the additional assumption of proximity to thermal equilibrium, implicitly implied by the use of Newtonian heat conduction in the original derivation. It seems that the results of the Curzon–Ahlborn analysis are always obtained in the high-temperature limit, irrespective of the details of the model. The performance beyond the classical limit is optimized numerically. The classical approximation is found to be valid for most of the spin-polarization range. The deviations from the classical limit depend heavily upon the specific nature of both the working fluid and the heat baths and exhibit great diversity and complexity.

DOI
10.1063/1.461951

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The finite-time operation of a quantum-mechanical heat engine with a working fluid consisting of many noninteracting spin-1/2 systems is considered. The engine is driven by an external, time-dependent and nonrotating magnetic field. The cycle of operation consists of two adiabats and two isotherms. The analysis is based on the time derivatives of the first and second laws of thermodynamics. Explicit relations linking quantum observables to thermodynamic quantities are developed. The irreversible operation of this engine is studied in three cases: (1) The sudden limit, where the performance is found to be the same as that of the spin analog of the Otto cycle. This case provides the lower bound of efficiency. (2) The step-cycle operation scheme. Here, the optimization of power is carried out in the high-temperature limit (the ‘‘classical’’ limit). The results obtained are similar to those of Andresen et al. [Phys. Rev. A 15, 2086 (1977)]. (3) The Curzon–Ahlborn operation scheme. The semigroup approach is used to model the dynamics. Then the power production is optimized. All the results obtained for Newtonian engines operating by the same scheme, such as the Curzon–Ahlborn efficiency, apply in the high-temperature limit. These results are obtained without the additional assumption of proximity to thermal equilibrium, implicitly implied by the use of Newtonian heat conduction in the original derivation. It seems that the results of the Curzon–Ahlborn analysis are always obtained in the high-temperature limit, irrespective of the details of the model. The performance beyond the classical limit is optimized numerically. The classical approximation is found to be valid for most of the spin-polarization range. The deviations from the classical limit depend heavily upon the specific nature of both the working fluid and the heat baths and exhibit great diversity and complexity.
The finite time performance of quantum heat engines has been examined with emphasis on the classical, high temperature, limit. Two basic engine models were studied, differing by their consistency of working fluid: the harmonic engine, consisting of noninteracting harmonic oscillators, and the spin-j engine, consisting of noninteracting spin-j subsystems. The two models represent two distinct types of engines, with bounded vs unbounded Hamiltonians, and with creation and annihilation operators of the Fermionic vs the Bosonic type. The analysis is based on the time derivatives of the first and second laws of thermodynamics. Explicit relations linking quantum observables to thermodynamic quantities are utilized. The dynamics of the engines was modeled by the semigroup approach. The engines were optimized with respect to various target functions: power, entropy production, and efficiency, while subject to finite cycle duration. The main strategy of optimization was based on the Euler–Lagrange equation, and is similar to that previously applied by Salamon and Nitzan for the investigation of Newtonian engines [J. Chem. Phys. 74, 3546 (1981)]. The optimal cycles obtained at the classical limit are not of the Curzon–Ahlborn type, i.e., the internal temperature along the thermal branches is not constant. This result is in conflict with Newtonian thermodynamics, where the optimal cycles are of the Curzon–Ahlborn type. Nonetheless, some of the main features of Newtonian thermodynamics, such as the Curzon–Ahlborn efficiency at maximum power, are reproduced at the classical limit. This makes it possible to establish a ‘‘thermodynamic correspondence principle.’’ This principle asserts that the phenomenological Newtonian thermodynamic approach provides an asymptote of a theory based upon the more fundamental semigroup quantum approach. It is argued that the asymptotic nature of Newtonian thermodynamics is twofold since its validity is restricted by two demands: that of high temperatures and that of proximity to equilibrium.
It is considered that the cycle of a quantum heat engine using many non-interacting spin-1/2 systems as the working substance is composed of two adiabatic and two isomagnetic field processes and is referred to as a spin quantum Brayton engine cycle. Based on the quantum master equation and semi-group approach, expressions for the efficiency and power output of the cycle are derived. By using numerical solutions, the power output of the heat engine subject to finite cycle duration is optimized. The maximum power output and the corresponding parameters are calculated numerically. The optimal region of the efficiency and the optimal ranges of temperatures of the working substance and times spent on the two isomagnetic field processes are determined, so that the general optimum performance characteristics of the cycle are revealed. Moreover, the optimal performance of the cycle in the high-temperature limit is also analysed in detail. The results obtained here are further generalized, so that they may be directly used to describe the performance of a quantum Brayton heat engine using spin-J systems as the working substance.
The unavoidable irreversible losses of power in a heat engine are found to be of quantum origin. Following thermodynamic tradition a model quantum heat engine operating by the Otto cycle is analyzed. The working medium of the model is composed of an ensemble of harmonic oscillators. A link is established between the quantum observables and thermodynamical variables based on the concept of canonical invariance. These quantum variables are sufficient to determine the state of the system and with it all thermodynamical variables. Conditions for optimal work, power and entropy production show that maximum power is a compromise between the quasistatic limit of adiabatic following on the compression and expansion branches and a sudden limit of very short time allocation to these branches. At high temperatures and quasistatic operating conditions the efficiency at maximum power coincides with the endoreversible result. The optimal compression ratio varies from the square root of the temperature ratio in the quasistatic limit where their reversibility is dominated by heat conductance to the temperature ratio to the power of 1/4 in the sudden limit when the irreversibility is dominated by friction. When the engine deviates from adiabatic conditions the performance is subject to friction. The origin of this friction can be traced to the noncommutability of the kinetic and potential energy of the working medium.
The unavoidable irreversible loss of power in a heat engine is found to be of quantum origin. Following thermodynamic tradition, a model quantum heat engine operating in an Otto cycle is analysed, where the working medium is composed of an ensemble of harmonic oscillators and changes in volume correspond to changes in the curvature of the potential well. Equations of motion for quantum observables are derived for the complete cycle of operation. These observables are sufficient to determine the state of the system and with it all thermodynamical variables. Once the external controls are set, the engine settles to a limit cycle. Conditions for optimal work, power and entropy production are derived. At high temperatures and quasistatic operating conditions, the efficiency at maximum power coincides with the endoreversible result . The optimal compression ratio varies from in the quasistatic limit where the irreversibility is dominated by heat conductance to in the sudden limit when the irreversibility is dominated by friction. When the engine deviates from adiabatic conditions, the performance is subject to friction. The origin of this friction can be traced to the noncommutability of the kinetic and potential energy of the working medium.
The quantum Otto cycle serves as a bridge between the macroscopic world of heat engines and the quantum regime of thermal devices composed from a single element. We compile recent studies of the quantum Otto cycle with a harmonic oscillator as a working medium. This model has the advantage that it is analytically trackable. In addition, an experimental realization has been achieved, employing a single ion in a harmonic trap. The review is embedded in the field of quantum thermodynamics and quantum open systems. The basic principles of the theory are explained by a specific example illuminating the basic definitions of work and heat. The relation between quantum observables and the state of the system is emphasized. The dynamical description of the cycle is based on a completely positive map formulated as a propagator for each stroke of the engine. Explicit solutions for these propagators are described on a vector space of quantum thermodynamical observables. These solutions which employ different assumptions and techniques are compared. The tradeoff between power and efficiency is the focal point of finite-time-thermodynamics. The dynamical model enables the study of finite time cycles limiting time on the adiabatic and the thermalization times. Explicit finite time solutions are found which are frictionless (meaning that no coherence is generated), and are also known as shortcuts to adiabaticity.The transition from frictionless to sudden adiabats is characterized by a non-hermitian degeneracy in the propagator. In addition, the influence of noise on the control is illustrated. These results are used to close the cycles either as engines or as refrigerators. The properties of the limit cycle are described. Methods to optimize the power by controlling the thermalization time are also introduced. At high temperatures, the Novikov–Curzon–Ahlborn efficiency at maximum power is obtained. The sudden limit of the engine which allows finite power at zero cycle time is shown. The refrigerator cycle is described within the frictionless limit, with emphasis on the cooling rate when the cold bath temperature approaches zero.
The purpose of this paper is to present a study of finite-time thermodynamics applied to evaluate the ecological performance of a quantum heat engine which operates between two thermal reservoirs using the working substance of spin-1/2 systems. The quantum heat engine cycle is composed of two isothermal processes, an adiabatic process and an isomagnetic field process. A sequence of time evolution was determined from the quantum angular momentum rate based on the semigroup approach and the quantum master equation. The individual time duration is added to account for the total cycle time. The objective ecological function representing a compromise between power output and irreversibility is maximized with respect to cycle temperature ratio. Effects of thermal reservoir temperature ratio and magnetic field ratio on the ecological function have been discussed. A comparison of quantum heat engine performance under maximum ecological function and maximum power conditions is also presented.