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Beyond Markovian dissipation at the nanoscale : towards finding quantum design rules for bio-organic nanodevices

Thibaut Lacroix

Published Jul 7, 2023• 0 citations
Publisher

Abstract

A better understanding of dissipation is crucial for understanding real-world quantum systems. Indeed, all quantum systems experience interactions with an (often) uncontrollable outside environment that can lead to a decay of excited state populations and a loss of quantum coherences. The study of dissipation is timely as the development of next-generation nanoscale quantum technologies is on its way, and the existence of non-trivial quantum effects in biological systems is being seriously investigated. However, descriptions of dissipation in quantum systems are reduced (most of the time) to time-local approaches and (everywhere) to space-local independent environments. These simplifying assumptions do render analytic and numerical calculations possible, yet they get rid of a breadth of physical processes that can alter radically the quantum systems' dynamics. In this thesis, building on a numerically exact tensor networks method, we developed a technique able to handle spatio-temporal correlations between a quantum system and bosonic (i.e. vibrational, electromagnetic, magnons, etc.) environments. With this method we studied the signalling process - a form of information backflow - in quantum systems, and uncovered how it can induce non-trivial dynamics, and be leveraged to populate otherwise inaccessible excited states. We also evidenced the ability of 'non-local' environment reorganisation, induced by system-environment interactions, to radically change the nature of the thermodynamically favoured system ground state. The new phenomenology of physical processes, resulting from considering quantum systems interacting with a common environment, has important consequences for the design of nanodevices as it gives access to new control, sensing and cross-talk mechanisms. In another vein, these results might also give us a new framework to study and interpret (quantum?) effects in the biological realm.

DOI
10.17630/sta/540

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New Journal of Physics•Nov 20, 2008•6 citations
A better understanding of dissipation is crucial for understanding real-world quantum systems. Indeed, all quantum systems experience interactions with an (often) uncontrollable outside environment that can lead to a decay of excited state populations and a loss of quantum coherences. The study of dissipation is timely as the development of next-generation nanoscale quantum technologies is on its way, and the existence of non-trivial quantum effects in biological systems is being seriously investigated. However, descriptions of dissipation in quantum systems are reduced (most of the time) to time-local approaches and (everywhere) to space-local independent environments. These simplifying assumptions do render analytic and numerical calculations possible, yet they get rid of a breadth of physical processes that can alter radically the quantum systems' dynamics. In this thesis, building on a numerically exact tensor networks method, we developed a technique able to handle spatio-temporal correlations between a quantum system and bosonic (i.e. vibrational, electromagnetic, magnons, etc.) environments. With this method we studied the signalling process - a form of information backflow - in quantum systems, and uncovered how it can induce non-trivial dynamics, and be leveraged to populate otherwise inaccessible excited states. We also evidenced the ability of 'non-local' environment reorganisation, induced by system-environment interactions, to radically change the nature of the thermodynamically favoured system ground state. The new phenomenology of physical processes, resulting from considering quantum systems interacting with a common environment, has important consequences for the design of nanodevices as it gives access to new control, sensing and cross-talk mechanisms. In another vein, these results might also give us a new framework to study and interpret (quantum?) effects in the biological realm.
Nanodevices exploiting quantum effects are critically important elements of future quantum technologies (QT), but their real-world performance is strongly limited by decoherence arising from local `environmental' interactions. Compounding this, as devices become more complex, i.e. contain multiple functional units, the `local' environments begin to overlap, creating the possibility of environmentally mediated decoherence phenomena on new time-and-length scales. Such complex and inherently non-Markovian dynamics could present a challenge for scaling up QT, but – on the other hand – the ability of environments to transfer `signals' and energy might also enable sophisticated spatiotemporal coordination of inter-component processes, as is suggested to happen in biological nanomachines, like enzymes and photosynthetic proteins. Exploiting numerically exact many body methods (tensor networks) we study a fully quantum model that allows us to explore how propagating environmental dynamics can instigate and direct the evolution of spatially remote, non-interacting quantum systems. We demonstrate how energy dissipated into the environment can be remotely harvested to create transient excited/reactive states, and also identify how reorganisation triggered by system excitation can qualitatively and reversibly alter the `downstream' kinetics of a `functional' quantum system. With access to complete system-environment wave functions, we elucidate the microscopic processes underlying these phenomena, providing new insight into how they could be exploited for energy efficient quantum devices.
Au delà de la dissipation markovienne à l’échelle nanométrique : vers la découverte de règles quantiques pour la conception de nano-dispositifs bio-organiques Une meilleure compréhension de la dissipation est cruciale pour décrire les systèmes quantiques de façon réaliste. En effet, tous les systèmes quantiques interagissent avec un environnement extérieur (souvent) incontrôlable qui peut conduire à une décroissance des populations d'états excités et à une perte de cohérence quantique. L'étude de la dissipation est opportune car le développement des technologies quantiques de nouvelle génération à l'échelle nanométrique est en cours, et l'existence d'effets quantiques non triviaux dans les systèmes biologiques est sérieusement étudiée. Cependant, les descriptions de la dissipation dans ces systèmes sont réduites (souvent) à des approches locales en temps et (partout) à des environnements locaux et indépendants. Ces hypothèses simplificatrices rendent les calculs analytiques et numériques possibles, mais elles font abstraction d'un grand nombre de processus physiques qui peuvent modifier radicalement la dynamique des systèmes quantiques. Dans cette thèse, en se basant sur une méthode de réseaux de tenseurs numériquement exacte, nous avons développé une technique capable de traiter les corrélations spatio-temporelles entre un système quantique et des environnements bosoniques (c.-à-d. vibrationel, électromagnétique, de magnons, etc.). Avec cette méthode, nous avons étudié le processus de signalisation - une forme de retour d'information (information backflow) - dans un système quantique, et nous avons découvert comment il peut induire une dynamique non triviale, et être utilisé pour peupler des états excités autrement inaccessibles. Nous avons également mis en évidence la capacité de la réorganisation "non locale" de l'environnement, induite par les interactions avec le système, à changer radicalement la nature de l'état fondamental thermodynamiquement favorisé du système. La nouvelle phénoménologie de processus physiques, résultant de la description de systèmes quantiques interagissant avec un environnement commun, a des conséquences importantes pour la conception de nano-dispositifs, car elle donne accès à de nouveaux mécanismes de contrôle, de détection et de diaphonie. Dans une autre direction, ces résultats pourraient également nous donner un nouveau cadre pour étudier et interpréter des effets (quantiques ?) dans le domaine biologique.
All real-world quantum systems interact with their surrounding environment to some extent. No matter how weak the coupling that prevents the system from being isolated, the evolution of an open quantum system is eventually plagued by non-unitary features, such as decoherence and dissipation. Decoherence is a quantum effect where the system loses its ability to exhibit coherent behavior. Nowadays, decoherence stands as a serious obstacle in quantum information processing. As the manipulation of quantum coherence in experiments has progressed, the need to better understand, control, and utilize dissipative non-equilibrium dynamics of quantum systems has grown in importance. This has ranged from fundamental questions associated with the quantum-to-classical transition and quantum thermodynamics innovation in quantum optics and cavity/circuit quantum electrodynamics. Current studies of many-body dynamics, ultracold atoms in optical lattices, trapped ions, superconducting systems, nanoelectro-mechanical systems, and quantum fields under the influence of external conditions offer new challenges to address questions regarding quantum systems far from equilibrium. On the theoretical side, quantum trajectory-based methods could be the key to both quantum nanodevice design and exploration of new regimes of quantum mechanics and quantum measurement, as well as applications to various quantum technologies.
Remarkable experimental progress and theoretical advancements in the study of strongly corre- lated systems have opened up new doors towards a better understanding of interesting states of matter. Such states could possibly be used to develop novel technological applications based on the principles of quantum mechanics. In recent years, the investigation of both complex solid state and ultracold atom systems has lead to a number of fascinating discoveries with regards to their non-equilibrium properties. One route to probe non-equilibrium physics is to consider the evolution of open systems defined by the coupling to an external environment introducing dissipation. Engineering the environment according to predefined requirements can then be used to dynamically prepare states which are difficult to access otherwise. This thesis explores the dynamics of many-body open quantum systems aiming at under- standing the effects resulting from the interplay of kinetic motion, interactions and dissipation in different physical settings. First, we build upon recent developments concerning the coupling of ultracold atoms to optical resonators which are subject to photon losses. We show how the dissipation can trigger an attractor dynamics towards a topologically non-trivial steady state that is robust against perturbations. The numerically obtained full open system evolution en- ables us to not only characterize in detail the steady state but also to analyze the features of the approaching dynamics. Second, we study the propagation of two-time correlation functions in interacting quantum spin-1/2 chains in contact with an environment causing dephasing. Pro- vided with the numerically exact full time-evolution, we identify an algebraic scaling regime where time-translation invariance breaks down and uncover the emergence of aging dynam- ics. Finally, we study a system of interacting fermionic atoms in a one-dimensional lattice with particle loss at the central site. There we report on the dissipation-induced deceleration of the non-equilibrium dynamics known as the quantum Zeno effect. As in the majority of cases quantum many-body systems are not solvable analytically, another central aspect of this thesis deals with adapting numerical methods based on matrix product state algorithms to investigate open quantum systems dynamics.
All systems are open to an essentially uncontrollable environment that acts as a source of decoherence and dissipation. In some cases the environment's only effect is to add a weak relaxation mechanism and thus can be ignored for short timescales. In others, however, the presence of the environment can fundamentally alter the behavior of the system. Such is the case in mesoscopic superconductors where the environment can stabilize superconductivity and in spin-boson systems where the environment induces a localization transition. Likewise, in technological applications we are often interested in systems operating far from equilibrium. Here the environment might act as a particle reservoir or strong driving force. In all these examples, we need accurate methods to describe the influence of the environment on the system and to solve for the resulting dynamics or equilibrium states. In this thesis, we develop computational and conceptual approaches to efficiently simulate quantum systems in contact with an environment. Our starting point is the use of numerical renormalization techniques. Thus, we restrict our attention to one-dimensional lattices or small quantum systems coupled to an environment. We have developed several complementary algorithms: a superoperator renormalization algorithm for simulating real-time Markovian dynamics and for calculating states in thermal equilibrium; a blocking algorithm for simulating integro-differential equations with long-time memory; and a tensor network algorithm for branched lattices, which can be used to simulate strongly dissipative systems. Further, we provide support for an idea that to generically and accurately simulate the real-time dynamics of strongly dissipative systems, one has to include all or part of the environment within the simulation. In addition, we discuss applications and open questions.
Quantum dissipation has been the object of study within the physics and chemistry communities for many years. Despite this, the field is in constant evolution, largely due to the fact that novel systems where the understanding of dissipation and dephasing processes is of crucial importance have become experimentally accessible in recent years. Among the ongoing research themes, we mention the defeat of decoherence in solid state-based quantum bits (qubits) (e.g. superconducting qubits or quantum dot based qubits), or dissipation due to non-equilibrium Fermi reservoirs, as is the case for quantum transport through meso- and nanoscale structures. A close inspection of dissipation in such systems reveals that one has to deal with 'unconventional' environments, where common assumptions of, for example, linearity of the bath and/or equilibrium reservoir have to be abandoned. Even for linear baths at equilibrium it might occur that the bath presents some internal structure, due, for example, to the presence of localized bath modes. A large part of this focus issue is devoted to topics related to the rapidly developing fields of quantum computation and information with solid state nanodevices. In these implementations, single and two-qubit gates as well as quantum information transmission takes place in the presence of broadband noise that is typically non-Markovian and nonlinear. On both the experimental and theory side, understanding and defeating such noise sources has become a crucial step towards the implementation of efficient nanodevices. On a more fundamental level, electron and spin transport through quantum dot nanostructures may suffer from 'unconventional' dissipation mechanisms such as the simultaneous presence of spin relaxation and fermionic dissipation, or may represent themselves out of equilibrium baths for nearby mesoscopic systems. Finally, although not expected from the outset, the present collection of articles has revealed that different 'unconventional' questions were still open on the standard harmonic oscillator and spin baths. This includes both fundamental issues, such as the possibility of estimating the specific heat for a free particle in the presence of dissipation, and the development of methods suitable to dealing with long range correlations at zero temperature and with quantum chaotic environments. We believe that the present focus issue on Quantum Dissipation in Unconventional Environments , although certainly not exhaustive, provides an important open-access resource that presents the latest state of the art of research in this field along its different lines. Focus on Quantum Dissipation in Unconventional Environments Contents Coherent control of an effective two-level system in a non-Markovian biomolecular environment J Eckel, J H Reina and M Thorwart Charge transfer dynamics in driven molecular ratchets: quantum Monte Carlo results and rate models L Mühlbacher and J Ankerhold Decoherence in qubits due to low-frequency noise J Bergli, Y M Galperin and B L Altshuler Dephasing by electron–electron interactions in a ballistic Mach–Zehnder interferometer Clemens Neuenhahn and Florian Marquardt Quantum frustration of dissipation by a spin bath D D Bhaktavatsala Rao, Heiner Kohler and Fernando Sols A random matrix theory of decoherence T Gorin, C Pineda, H Kohler and T H Seligman Dissipative dynamics of a biased qubit coupled to a harmonic oscillator: analytical results beyond the rotating wave approximation Johannes Hausinger and Milena Grifoni Dissipative dynamics of a two-level system resonantly coupled to a harmonic mode Frederico Brito and Amir O Caldeira Spin correlations in spin blockade Rafael Sánchez, Sigmund Kohler and Gloria Platero Landau–Zener tunnelling in dissipative circuit QED David Zueco, Peter Hänggi and Sigmund Kohler Quantum oscillations in the spin-boson model: reduced visibility from non-Markovian effects and initial entanglement F K Wilhelm Dynamics of dissipative coupled spins: decoherence, relaxation and effects of a spin-boson bath P Nägele, G Campagnano and U Weiss Spin chain model for correlated quantum channels Davide Rossini, Vittorio Giovannetti and Simone Montangero Finite quantum dissipation: the challenge of obtaining specific heat Peter Hänggi, Gert-Ludwig Ingold and Peter Talkner Dynamics of large anisotropic spin in a sub-ohmic dissipative environment close to a quantum-phase transition Frithjof B Anders Effects of low-frequency noise cross-correlations in coupled superconducting qubits A D'Arrigo, A Mastellone, E Paladino and G Falci From coherent motion to localization: dynamics of the spin-boson model at zero temperature Haobin Wang and Michael Thoss Phonon distributions of a single-bath mode coupled to a quantum dot F Cavaliere, G Piovano, E Paladino and M Sassetti