Within a quantum-thermodynamical approach a single subsystem can be shown to relax to a thermal state if appropriately embedded in a quantum environment. This picture appears to be at variance with the foundations of statistical mechanics, according to which thermal properties emerge either as a long-time or ensemble average. Here we argue that periodic measurements on the environment may establish the missing link: we consider a two-level system (TLS) coupled to an environment consisting of many spins, the magnetization of which is measured periodically. These measurements destroy system-environment correlations and influence the state of the TLS due to so-called co-jumps, which lead to quasi-classical trajectories for the TLS. We derive an analytical solution for the ensemble-averaged attractor state reached after many measurements. Reinterpreting the setup as an indirect measurement process for the TLS also sheds new light on the properties of such periodic indirect measurements.
Within a quantum-thermodynamical approach a single subsystem can be shown to relax to a thermal state if appropriately embedded in a quantum environment. This picture appears to be at variance with the foundations of statistical mechanics, according to which thermal properties emerge either as a long-time or ensemble average. Here we argue that periodic measurements on the environment may establish the missing link: we consider a two-level system (TLS) coupled to an environment consisting of many spins, the magnetization of which is measured periodically. These measurements destroy system-environment correlations and influence the state of the TLS due to so-called co-jumps, which lead to quasi-classical trajectories for the TLS. We derive an analytical solution for the ensemble-averaged attractor state reached after many measurements. Reinterpreting the setup as an indirect measurement process for the TLS also sheds new light on the properties of such periodic indirect measurements.
The rather new field of quantum thermodynamics intends to derive thermodynamics from quantum mechanics, as well as to study thermodynamical behavior of quantum systems. It turns out that, indeed, thermalization can be obtained even for very small quantum systems due to the interaction with an appropriate environment. The consideration of an ensemble, as in statistical mechanics, is not necessary. However, the total system - consisting of system and environment - in quantum thermodynamics is usually considered to be closed. In particular, there exists no interaction with an external observer. Since quantum measurements typically influence the measured system, one may wonder which influence such an observation will have in the quantum thermodynamical setting. In this thesis, we study this influence of measurements in quantum thermodynamical systems. It turns out that various concepts known from statistical mechanics arise from such a "quantum thermodynamics under observation", although they do not have any meaning in the isolated quantum thermodynamical setting. The model discussed in the first part consists of a two-level system coupled to a large spin environment, the magnetization of which is measured periodically. This leads to quasi-classical trajectories for the system and - as in statistical mechanics - thermalization and temperature only have a meaning in terms of an ensemble average or a long-time average. Calculating these averages, we prove the ergodicity of the system. Interestingly, the entropy of the obtained attractor state depends on the time between the measurements and can be shown to be connected with the subjective lack of knowledge of the observer. In case of optimal measurements, the ensemble averaged state of the system under periodic measurements equals the state of the system in the quantum thermodynamical model without measurements. Introducing a detuning between system and environment, we find that the system can be prepared in almost arbitrary thermal states due to the periodic measurements. Even the creation of inversion becomes possible. As shown in numerical simulations, our results, which were analytically obtained for large environments, are even applicable to describe the behavior of the system coupled to small environments consisting of only a few spins. Besides measurements of the environment, we also study direct projective measurements of the system, as well as measurements with finite duration, obtaining that the dynamics of the system is almost independent of the concrete realization of the measurements. In the second part of the thesis, we discuss the meaning of temperature fluctuations in quantum thermodynamical systems. In statistical mechanics, there exist different approaches to the problem of temperature fluctuations, which lead to the well-known temperature fluctuation formula. The nature and operational accessibility of these fluctuations, however, remains rather unclear. We argue that according to quantum thermodynamics a system relaxes into a quasi-stationary thermal state and therefore the temperature does not fluctuate. However, since temperature is not an observable, it can only be determined indirectly. For modular systems, we show that the fluctuations of the temperature estimate obtained from a single energy measurement, indeed, are given by the temperature fluctuation formula derived in statistical mechanics, but only within a certain temperature range. The validity range of this formula increases with increasing size of the system. Thus, one can conclude that these "temperature fluctuations" can be interpreted as representing a fundamental limit for the instantaneous determination of temperature.
In this paper, we discuss how effective environments incorporating periodic measurements can be used to prepare a two-level system (TLS) in almost arbitrary thermal states: Concretely, we study a TLS coupled to a spin environment, the magnetization of which is measured periodically. In ensemble average these measurements cause a relaxation of the TLS into a thermal (diagonal) state. By adjusting the time between the measurements and the detuning of the environmental spins, the creation of very low temperatures as well as inversion becomes possible. Our analytical results derived for large environments are numerically shown to be valid even for quite small environments, down to only a few spins.
Recently, the possibility of investigating single molecule, or single spin observables, as well as the necessity of a better understanding of the mechanisms underlying quantum dynamics in order to obtain nanoscale devices and nanostructered materials suitable for quantum computing tasks, have revived the interest in foundational aspects of quantum statistical mechanics. This thesis aims to give a contribution to this field by re-considering the statistical characterization of a quantum system at the light of some paradigmatic changes in our understanding of quantum theory which have taken place in the last two decades. In particular the impressive development of quantum information theory has changed the perceptions of quantum entanglement: for a long time it has been considered a somewhat paradoxical property of the matter at the atomic scale, but now it is regarded as an essential and ubiquitous phenomenon whose consequences are affecting the very macroscopic world that we experience. Still the decoherence program has brought out the importance of considering a quantum system together with its environment in order to clarify some key aspects of quantum dynamics. Thus, we start from the idea that quantum correlations are ubiquitous and somewhat uncontrollable in systems with many degrees of freedom which are typically considered in statistical mechanics. As a consequence we assume the standpoint that quantum statistical mechanics has not to be based on the underlying idea of a collection of many, independent quantum systems but rather it has to emerge at the level of a global wavefunction (pure state) which describes the system as well as its environment as a whole. In order to investigate the consequences of these assumptions we study the equilibrium distribution of an isolated quantum system. This is defined, in analogy with the ergodic foundations of classical statistical mechanics, on the basis of the time evolution of the quantum state. Then, we study the emergence of thermodynamic properties in a quantum system by studying the probability distribution of some function of interests, as the entropy and the equilibrium state of a subsystem, on Ensembles of Pure States. Such a probability distribution is derived from the geometry of the Hilbert space, and the theoretical tools suitable for its characterization are developed. On the one hand we perform a numerical sampling of the ensemble distributions by employing Monte Carlo techniques, on the other hand simpler analytical approximation of the geometrical distributions are derived by means of a maximum entropy principle. Model systems composed of an ensemble of spins are chosen to illustrate the salient features which emerge from the developed theoretical framework: the main point is that the Ensemble Distributions of “thermodynamic observables” (entropy or equilibrium state of a subsystem) are sharply peaked around a typical value. From the analysis it emerges that each of the overwhelming majority of the wavefunctions which has appreciable weight in the considered ensemble, is characterized by the same value of the “macroscopic” functions. This is a striking evidence of the “typicality” of these properties. In the essence, our impossibility to know the state of the system in detail does not matter, just for the remarkable fact that almost all quantum states behave essentially in the same way. By virtue of this typicality the study of the behaviour of the typical values of the thermodynamic function become meaningful. Notably, under certain conditions, one recovers the results of standard statistical mechanics, that is, the equilibrium average of the state of a subsystem can be cast in the Boltzmann canonical form at the temperature given by the usual thermodynamical relation . In the second part of the thesis we consider the dynamical aspects of the equilibrium state of a subsystem interacting with its environment. The fluctuations around the equilibrium average critically depends on the entanglement between the system and the environment and on the form of the interaction Hamiltonian. The connection between the dynamics of the fluctuations of an observable at the equilibrium and the relaxation toward the equilibrium from a “non typical” initial value is also investigated with the aid of simple model systems. The study presented in this thesis was partly motivated by a critical analysis of the statistical methods available for the theoretical modelling of magnetic resonance experiments. One of these, the Stochastic Liouville Equation, has been employed in a work completed during the first year of my Ph.D. program in order to interpret some feature of a two dimensional electron spin resonance experiment, [Fresch B., Frezzato D., Moro G. J., Kothe G., Freed J. H.; J. Phys. Chem. B., 110, 24238, (2006)].
Investigation on foundational aspects of quantum statistical mechanics recently entered a renaissance period due to novel intuitions from quantum information theory and to increasing attention on the dynamical aspects of single quantum systems. In the present contribution a simple but effective theoretical framework is introduced to clarify the connections between a purely mechanical description and the thermodynamic characterization of the equilibrium state of an isolated quantum system. A salient feature of our approach is the very transparent distinction between the statistical aspects and the dynamical aspects in the description of isolated quantum systems. Like in the classical statistical mechanics, the equilibrium distribution of any property is identified on the basis of the time evolution of the considered system. As a consequence equilibrium properties of quantum system appear to depend on the details of the initial state due to the abundance of constants of the motion in the Schrodinger dynamics. On the other hand the study of the probability distributions of some functions, such as the entropy or the equilibrium state of a subsystem, in statistical ensembles of pure states reveals the crucial role of typicality as the bridge between macroscopic thermodynamics and microscopic quantum dynamics. We shall consider two particular ensembles: the random pure state ensemble and the fixed expectation energy ensemble. The relation between the introduced ensembles, the properties of a given isolated system, and the standard quantum statistical description are discussed throughout the presentation. Finally we point out the conditions which should be satisfied by an ensemble in order to get meaningful thermodynamical characterization of an isolated quantum system.
We explore some aspects of nonequilibrium statistical mechanics of classical and quantum systems. Two chapters are devoted to fluctuation theorems which were originally derived for classical systems. The main challenge in formulating them in quantum mechanics is the fact that fundamental quantities of interest, like work, are defined via the classical concept of a phase space trajectory. We utilize the decoherent histories conceptual framework, in which classical trajectories emerge in quantum mechanics as a result of coarse graining, and provide a first-principles analysis of the nonequilibrium work relation of Jarzynski and Crooks's fluctuation theorem for a quantum system interacting with a general environment based on the quantum Brownian motion (QBM) model. We indicate a parameter range at low temperatures where the theorems might fail in their original form. Fluctuation theorems of Jarzynski and Crooks for systems obeying classical Hamiltonian dynamics are derived under the assumption that the initial conditions are sampled from a canonical ensemble, even though the equilibrium state of an isolated system is typically associated with the microcanonical ensemble. We address this issue through an exact analysis of the classical Brownian motion model. We argue that a stronger form of ensemble equivalence than usually discussed in equilibrium statistical mechanics is required for these theorems to hold in the infinite environment limit irrespective of the ensemble used, and proceed to prove it for this model. An exact expression for the probability distribution of work is obtained for finite environments. Intuitively one expects a system to relax to an equilibrium state when brought into contact with a thermal environment. Yet it is important to have rigorous results that provide conditions for equilibration and characterize the equilibrium state. We consider the dynamics of open quantum systems using the Langevin and master equations and rigorously show that under fairly general conditions quantum systems interacting with a heat bath relax to the equilibrium state defined as the reduced thermal state of the system plus environment, even in the strong coupling regime. Our proof is valid to second-order in interaction strength for general systems and exact for the linear QBM model, for which we also show the equivalence of multi-time correlations. In the final chapter we give a sampling of our investigations into macroscopic quantum phenomena. We work out in detail a specific example of how and under what conditions the center of mass (CoM) coordinate of a macroscopic object emerges as the relevant degree of freedom. Interaction patterns are studied in terms of the couplings they induce between the CoM and relative coordinates of two macroscopic objects. We discuss the implications of these interaction patterns on macroscopic entanglement.
Driven quantum systems are systems in which a set of parameters obeys a time-dependent protocol, both periodic and non-periodic. The study of these systems bridges theoretical advances with experimental realizations in a variety of platforms—these range from quantum dot arrays to molecular junctions to trapped ions. The theoretical study is challenging due to the inherent non-equilibrium nature of the problem. These systems offer an interesting playground for quantum thermodynamics. They can be studied as quantum machines, such as refrigerators, heat pumps or engines. This poses the challenge of redefining the laws of thermodynamics in the quantum realm. This effort implies taking into account the presence of coherence, entanglement and strong correlations with the environment. In this conceptual framework, we attempt to shed new light on specific setups with applications in quantum metrology. In the first part of the Thesis, we present novel results on the thermodynamics and transport properties of quantum dots. After thoroughly introducing the main methods, namely non-equilibrium Green's functions and scattering matrix techniques, we apply these tools to adiabatic charge pumping. In this context, quantum dots, subjected to external periodic driving, act as nano-mechanical engines, transferring charge from a source to a drain. We investigate the conditions under which the pumped charge becomes quantized and how thermodynamic quantities behave in this regime. Next, we will focus on the charge shuttle mechanism in movable quantum dots as an example of a quantum clock. This physical model describes transport through a molecular state bound to two leads by van der Waals forces, with an electric field pushing the molecule from the source to the drain. The periodic oscillations arising from the system's dissipative limit cycle solution provide the basis for time measurement. We examine quantum noise primarily associated with the tunnelling process. In the second part, we propose a quantum clock that utilizes the free energy resources generated by coupling to a quantum battery, consisting of an integrable spin chain driven out of equilibrium by a quench in a chosen parameter. The operating conditions of the clock in the manifold of parameters are examined, leading to the requirement of the crossing of the critical point in the battery. The lifetime of the battery's resources is found to be extensive in its size, even when choosing a global coupling observable in the battery.