Dissipation and Control in Microscopic Nonequilibrium Systems

Dissipation and Control in Microscopic Nonequilibrium Systems PDF

Author: Steven J. Large

Publisher: Springer Nature

Published: 2021-10-23

Total Pages: 240

ISBN-13: 3030858251

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This thesis establishes a multifaceted extension of the deterministic control framework that has been a workhorse of nonequilibrium statistical mechanics, to stochastic, discrete, and autonomous control mechanisms. This facilitates the application of ideas from stochastic thermodynamics to the understanding of molecular machines in nanotechnology and in living things. It also gives a scale on which to evaluate the nonequilibrium energetic efficiency of molecular machines, guidelines for designing effective synthetic machines, and a perspective on the engineering principles that govern efficient microscopic energy transduction far from equilibrium. The thesis also documents the author’s design, analysis, and interpretation of the first experimental demonstration of the utility of this generally applicable method for designing energetically-efficient control in biomolecules. Protocols designed using this framework systematically reduced dissipation, when compared to naive protocols, in DNA hairpins across a wide range of experimental unfolding speeds and between sequences with wildly different physical characteristics.

Dissipation and Control in Microscopic Nonequilibrium Systems

Dissipation and Control in Microscopic Nonequilibrium Systems PDF

Author: Lord Large

Publisher:

Published: 2020

Total Pages: 214

ISBN-13:

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Quantifying the flow of energy, entropy, and information within and through nonequilibrium systems remains a central challenge in understanding the microscopic physics of biological systems. Over the past two and a half decades, parallel developments in the fields of theoretical stochastic thermodynamics and single-molecule experiments have made tremendous steps towards this end, advancing our understanding of the fundamental physical limitations and constraints faced by biological systems in vivo. Central in this focus are molecular machines: nanoscale protein complexes which interconvert between different forms of energy to perform useful functions to the cell. While single-molecule experiments on molecular machines have predicted impressively high efficiencies, much is still unknown about their performance in vivo. In this thesis we build upon these primitives, largely by making use of near-equilibrium phenomenological models to simplify and make tractable the problem of quantifying dissipation in molecular machines and predicting the operational modes which are imperative to minimizing their dissipation. By exploring the relevance of near-equilibrium models in the experimental investigation of a DNA hairpin, we find that such an approach can provide utility in understanding the strategies to reduce dissipation in nonequilibrium processes. However, single-molecule manipulations are significantly separated from the in vivo dynamics of molecular machines, and thus for the remainder of the thesis we expand upon this approach in various ways, generalizing the existing theoretical framework to more closely parallel the dynamics of molecular machines. By incorporating the inter-system feedback present in molecular machines, we find that familiar intuitions about how excess work and entropy production are related break down. Finally, we derive a phenomenological expression for the energy flows communicated within the components of a mechanochemical molecular machine. Ultimately, our analysis shows that intersystem feedback can lead to nonvanishing energy flows which are the manifestation of a Maxwell demon in the molecular machine itself.

Irreversibility and Dissipation in Microscopic Systems

Irreversibility and Dissipation in Microscopic Systems PDF

Author: Édgar Roldán

Publisher: Springer

Published: 2016-09-17

Total Pages: 0

ISBN-13: 9783319383842

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After an insightful introductory part on recent developments in the thermodynamics of small systems, the author presents his contribution to a long-standing problem, namely the connection between irreversibility and dissipation. He develops a method based on recent results on fluctuation theorems that is able to estimate dissipation using only information acquired in a single, sufficiently long, trajectory of a stationary nonequilibrium process. This part ends with a remarkable application of the method to the analysis of biological data, in this case, the fluctuations of a hair bundle. The third part studies the energetics of systems that undergo symmetry breaking transitions. These theoretical ideas lead to, among other things, an experimental realization of a Szilard engine using manipulated colloids. This work has the potential for important applications ranging from the analysis of biological media to the design of novel artificial nano-machines.

Non-Dissipative Effects in Nonequilibrium Systems

Non-Dissipative Effects in Nonequilibrium Systems PDF

Author: Christian Maes

Publisher: Springer

Published: 2017-09-20

Total Pages: 56

ISBN-13: 3319677802

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This book introduces and discusses both the fundamental aspects and the measurability of applications of time-symmetric kinetic quantities, outlining the features that constitute the non-dissipative branch of non-equilibrium physics. These specific features of non-equilibrium dynamics have largely been ignored in standard statistical mechanics texts. This introductory-level book offers novel material that does not take the traditional line of extending standard thermodynamics to the irreversible domain. It shows that although stationary dissipation is essentially equivalent with steady non-equilibrium and ubiquitous in complex phenomena, non-equilibrium is not determined solely by the time-antisymmetric sector of energy-entropy considerations. While this should not be very surprising, this book provides timely, simple reminders of the role of time-symmetric and kinetic aspects in the construction of non-equilibrium statistical mechanics.

Irreversibility and Dissipation in Microscopic Systems

Irreversibility and Dissipation in Microscopic Systems PDF

Author: Édgar Roldán

Publisher: Springer

Published: 2014-06-13

Total Pages: 219

ISBN-13: 3319070797

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After an insightful introductory part on recent developments in the thermodynamics of small systems, the author presents his contribution to a long-standing problem, namely the connection between irreversibility and dissipation. He develops a method based on recent results on fluctuation theorems that is able to estimate dissipation using only information acquired in a single, sufficiently long, trajectory of a stationary nonequilibrium process. This part ends with a remarkable application of the method to the analysis of biological data, in this case, the fluctuations of a hair bundle. The third part studies the energetics of systems that undergo symmetry breaking transitions. These theoretical ideas lead to, among other things, an experimental realization of a Szilard engine using manipulated colloids. This work has the potential for important applications ranging from the analysis of biological media to the design of novel artificial nano-machines.

Non-Reciprocal Materials and Systems

Non-Reciprocal Materials and Systems PDF

Author: Prabhakar Bandaru

Publisher: Elsevier

Published: 2024-01-22

Total Pages: 476

ISBN-13: 032398312X

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Non-Reciprocal Materials and Systems: An Engineering Approach to the Control of Light, Sound, and Heat discusses the related concept of bound states which help confine sound and electromagnetic waves and can also lead to the control of thermal energy. The requirements for the formation of such bound states, their relationship to physical and topological characteristics of materials, and the possible application to new devices is considered. The book takes a unique approach to energy transfer in and between materials systems - considering dimensional effects, supersonic, transonic and subsonic wave motion, as well as the coupling of waves. This book is suitable for researchers in materials science, condensed matter physics, electrical, mechanical, and structural engineering, and technologists aiming for better control of non-electronic physical phenomena. Provides information on how to use specific features in new and artificial materials for the control of sound, light and heat Explores dimensional considerations such as surface material phenomena that can be decoupled from bulk materials or the inside of a material Discusses new device concepts and related technologies such as energy sources, isolators, and diodes involving energy confinement

Microscopic And Macroscopic Simulation Techniques: Kharagpur Lectures

Microscopic And Macroscopic Simulation Techniques: Kharagpur Lectures PDF

Author: Hoover William Graham

Publisher: World Scientific

Published: 2018-03-13

Total Pages: 412

ISBN-13: 9813232544

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This book aims to provide an example-based education in numerical methods for atomistic and continuum simulations of systems at and away from equilibrium. The focus is on nonequilibrium systems, stressing the use of tools from dynamical systems theory for their analysis. Lyapunov instability and fractal dimensionality are introduced and algorithms for their analysis are detailed. The book is intended to be self-contained and accessible to students who are comfortable with calculus and differential equations. The wide range of topics covered will provide students, researchers and academics with effective tools for formulating and solving interesting problems, both atomistic and continuum. The detailed description of the use of thermostats to control nonequilibrium systems will help readers in writing their own programs rather than being saddled with packaged software. Contents: Mechanics, Molecular Dynamics, and Gibbs' Statistical Mechanics Numerical Integration and Error Analysis Molecular Dynamics with Thermostats Simple Systems with Thermal Constraints Ergodicity and Its Importance in Small Systems Equilibrium Thermodynamics + Nonequilibrium Hydrodynamics Statistical Mechanics of Small Systems Microscopic Reversibility, Macroscopic Irreversibility Lyapunov Instability, Fractals, and Chaos I Lyapunov Instability, Fractals, and Chaos II Smooth-Particle Continuum Mechanics Epilogue Readership: Undergraduate, graduate students, researchers focusing on statistical mechanics and numerical simulation. Keywords: Numerical Methods;Simulation;Nonequilibrium;Molecular Dynamics;Continuum Mechanics;Statistical Mechanics;Chaos;Lyapunov Instability;Hydrodynamics;ThermodynamicsReview: Key Features: Three useful areas covered — treatment of control variables such as thermostats and ergostats, dynamical system analysis and the use of smooth particle techniques for analyzing molecular dynamics, and the solution of continuum problems

Simulation and Control of Chaotic Nonequilibrium Systems

Simulation and Control of Chaotic Nonequilibrium Systems PDF

Author: William Graham Hoover

Publisher: World Scientific Publishing Company Incorporated

Published: 2015

Total Pages: 295

ISBN-13: 9789814656825

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This book aims to provide a lively working knowledge of the thermodynamic control of microscopic simulations, while summarizing the historical development of the subject, along with some personal reminiscences. Many computational examples are described so that they are well-suited to learning by doing. The contents enhance the current understanding of the reversibility paradox and are accessible to advanced undergraduates and researchers in physics, computation, and irreversible thermodynamics.

Simulation And Control Of Chaotic Nonequilibrium Systems: With A Foreword By Julien Clinton Sprott

Simulation And Control Of Chaotic Nonequilibrium Systems: With A Foreword By Julien Clinton Sprott PDF

Author: William Graham Hoover

Publisher: World Scientific Publishing Company

Published: 2015-02-02

Total Pages: 325

ISBN-13: 9814656844

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This book aims to provide a lively working knowledge of the thermodynamic control of microscopic simulations, while summarizing the historical development of the subject, along with some personal reminiscences. Many computational examples are described so that they are well-suited to learning by doing. The contents enhance the current understanding of the reversibility paradox and are accessible to advanced undergraduates and researchers in physics, computation, and irreversible thermodynamics.

Non-Equilibrium Statistical Mechanics

Non-Equilibrium Statistical Mechanics PDF

Author: James H. Luscombe

Publisher: CRC Press

Published: 2024-09-23

Total Pages: 257

ISBN-13: 1040118798

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Statistical mechanics provides a framework for relating the properties of macroscopic systems (large collections of atoms, such as in a solid) to the microscopic properties of its parts. However, what happens when macroscopic systems are not in thermal equilibrium, where time is not only a relevant variable, but also essential? That is the province of nonequilibrium statistical mechanics – there are many ways for systems to be out of equilibrium! The subject is governed by fewer general principles than equilibrium statistical mechanics and consists of a number of different approaches for describing nonequilibrium systems. Financial markets are analyzed using methods of nonequilibrium statistical physics, such as the Fokker-Planck equation. Any system of sufficient complexity can be analyzed using the methods of nonequilibrium statistical mechanics. The Boltzmann equation is used frequently in the analysis of systems out of thermal equilibrium, from electron transport in semiconductors to modeling the early Universe following the Big Bang. This book provides an accessible yet very thorough introduction to nonequilibrium statistical mechanics, building on the author's years of teaching experience. Covering a broad range of advanced, extension topics, it can be used to support advanced courses on statistical mechanics, or as a supplementary text for core courses in this field. Key Features: Features a clear, accessible writing style which enables the author to take a sophisticated approach to the subject, but in a way that is suitable for advanced undergraduate students and above Presents foundations of probability theory and stochastic processes and treats principles and basic methods of kinetic theory and time correlation functions Accompanied by separate volumes on thermodynamics and equilibrium statistical mechanics, which can be used in conjunction with this book