Predicting thermodynamic quantities for chemically realistic systems on the basis of atomistic calculations is still, even today, a nontrivial task. Nonetheless, accurate treatment of inter-particle interactions, in terms of quantum chemical first principles methods, is a prerequisite for many applications, because of the complexity of both reactants and solvents in modern molecular sciences. Currently, a straightforward calculation of thermodynamic properties from these methods is only possible for high-temperature and low- density systems. Although the enthalpy of a system can often be predicted to a good level of precision with this ideal gas approach, calculating the entropy contribution to the free energy is problematic, especially as the density of the system increases. This thesis contains a compact and coherent introduction of basic theoretical features. The foundations are then laid for the development of approaches suitable for calculation of condensed phase entropies on the basis of well-established quantum chemical methods. The main emphasis of this work is on realistic systems in solution, which is the most important environment for chemical synthesis. The presented results demonstrate how isolated molecular concepts typically employed in modern quantum chemistry can be extended for the accurate determination of thermodynamic properties by means of scale- transferring approaches.

This book presents the state of the art in social simulation as presented at the Social Simulation Conference 2019 in Mainz, Germany. It covers the developments in applications and methods of social simulation, addressing societal issues such as socio-ecological systems and policymaking. Methodological issues discussed include large-scale empirical calibration, model sharing and interdisciplinary research, as well as decision-making models, validation and the use of qualitative data in simulation modeling. Research areas covered include archaeology, cognitive science, economics, organization science and social simulation education. This book gives readers insight into the increasing use of social simulation in both its theoretical development and in practical applications such as policymaking whereby modeling and the behavior of complex systems is key. The book appeals to students, researchers and professionals in the various fields.

Based on courses given at the universities of Texas and California, this book treats an active field of research that touches upon the foundations of physics and chemistry. It presents, in as simple a manner as possible, the basic mechanisms that determine the dynamical evolution of both classical and quantum systems in sufficient generality to include quantum phenomena. The book begins with a discussion of Noether's theorem, integrability, KAM theory, and a definition of chaotic behavior; continues with a detailed discussion of area-preserving maps, integrable quantum systems, spectral properties, path integrals, and periodically driven systems; and concludes by showing how to apply the ideas to stochastic systems. The presentation is complete and self-contained; appendices provide much of the needed mathematical background, and there are extensive references to the current literature; while problems at the ends of chapters help students clarify their understanding. This new edition has an updated presentation throughout, and a new chapter on open quantum systems.

This book shows how neural networks are applied to computational mechanics. Part I presents the fundamentals of neural networks and other machine learning method in computational mechanics. Part II highlights the applications of neural networks to a variety of problems of computational mechanics. The final chapter gives perspectives to the applications of the deep learning to computational mechanics.

This book provides an overview of advanced prediction and verification technologies for aerodynamics and aerothermodynamics and assesses a number of critical issues in advanced hypersonic vehicle design. Focusing on state-of-the-art theories and promising technologies for engineering applications, it also presents a range of representative practical test cases. Given its scope, the book offers a valuable asset for researchers who are interested in thermodynamics, aircraft design, wind tunnel testing, fluid dynamics and aerothermodynamics research methods, introducing them to inspiring new research topics.

This book is based on many years of teaching statistical and thermal physics. It assumes no previous knowledge of thermodynamics, kinetic theory, or probability---the only prerequisites are an elementary knowledge of classical and modern physics, and of multivariable calculus. The first half of the book introduces the subject inductively but rigorously, proceeding from the concrete and specific to the abstract and general. In clear physical language the book explains the key concepts, such as temperature, heat, entropy, free energy, chemical potential, and distributions, both classical and quantum. The second half of the book applies these concepts to a wide variety of phenomena, including perfect gases, heat engines, and transport processes. Each chapter contains fully worked examples and real-world problems drawn from physics, astronomy, biology, chemistry, electronics, and mechanical engineering.

This book contains contributions presented at the 12th International Conference on Complex Networks (CompleNet), 24-26 May 2021. CompleNet is an international conference on complex networks that brings together researchers and practitioners from diverse disciplines-from sociology, biology, physics, and computer science-who share a passion to better understand the interdependencies within and across systems. CompleNet is a venue to discuss ideas and findings about all types networks, from biological, to technological, to informational and social. It is this interdisciplinary nature of complex networks that CompleNet aims to explore and celebrate.

Providing a comprehensive introduction to quantum field theory, this textbook covers the development of particle physics from its foundations to the discovery of the Higgs boson. Its combination of clear physical explanations, with direct connections to experimental data, and mathematical rigor make the subject accessible to students with a wide variety of backgrounds and interests. Assuming only an undergraduate-level understanding of quantum mechanics, the book steadily develops the Standard Model and state-of-the-art calculation techniques. It includes multiple derivations of many important results, with modern methods such as effective field theory and the renormalization group playing a prominent role. Numerous worked examples and end-of-chapter problems enable students to reproduce classic results and to master quantum field theory as it is used today. Based on a course taught by the author over many years, this book is ideal for an introductory to advanced quantum field theory sequence or for independent study.

Written by leading experts in their respective fields, Solidification and Casting provides a comprehensive review of topics fundamental to metallurgy and materials science as well as indicates recent trends.
From an industrial perspective, the book begins with chapters on the casting techniques most commonly used in industry today. It then describes the underlying science fundamental to solidification mechanisms, including fluid flow, the effects of cooling rates, modern simulation, and modelling methods in use and their application in various casting scenarios. Next, the authors consider the microstructure of cast materials and their defects, and explore how different casting processes can control these parameters. The book concludes with the most recent developments in the field and discusses new processes and materials, such as novel alloys and composites, metallic glasses, ceramics, and superconducting oxides.

A modern and broad exposition emphasizing heat transfer by convection. This edition contains valuable new information primarily pertaining to flow and heat transfer in porous media and computational fluid dynamics as well as recent advances in turbulence modeling. Problems of a mixed theoretical and practical nature provide an opportunity to test mastery of the material.

Philosophy in Reality offers a new vision of the relation between science and philosophy in the framework of a non-propositional logic of real processes, grounded in the physics of the real world. This logical system is based on the work of the Franco-Romanian thinker Stephane Lupasco (1900-1988), previously presented by Joseph Brenner in the book Logic in Reality (Springer, 2008). The present book was inspired in part by the ancient Chinese Book of Changes (I Ching) and its scientific-philosophical discussion of change. The emphasis in Philosophy in Reality is on the recovery of dialectics and semantics from reductionist applications and their incorporation into a new synthetic paradigm for knowledge. Through an original re-interpretation of both classical and modern Western thought, this book addresses philosophical issues in scientific fields as well as long-standing conceptual problems such as the origin, nature and role of meaning, the unity of knowledge and the origin of morality. In a rigorous transdisciplinary manner, it discusses foundational and current issues in the physical sciences - mathematics, information, communication and systems theory and their implications for philosophy. The same framework is applied to problems of the origins of society, the transformation of reality by human subjects, and the emergence of a global, sustainable information society. In summary, Philosophy in Reality provides a wealth of new perspectives and references, supporting research by both philosophers and physical and social scientists concerned with the many facets of reality.

Presenting in a coherent and accessible fashion current results in nanomagnetism, this book constitutes a comprehensive, rigorous and readable account, from first principles of the classical and quantum theories underlying the dynamics of magnetic nanoparticles subject to thermal fluctuations.Starting with the Larmor-like equation for a giant spin, both the stochastic (Langevin) equation of motion of the magnetization and the associated evolution (Fokker-Planck) equation for the distribution function of the magnetization orientations of ferromagnetic nanoparticles (classical spins) in a heat bath are developed along with their solution (using angular momentum theory) for arbitrary magnetocrystalline-Zeeman energy. Thus, observables such as the magnetization reversal time, relaxation functions, dynamic susceptibilities, etc. are calculated and compared with the predictions of classical escape rate theory including in the most general case spin-torque-transfer. Regarding quantum effects, which are based on the reduced spin density matrix evolution equation in Hilbert space as is described at length, they are comprehensively treated via the Wigner-Stratonovich formulation of the quantum mechanics of spins via their orientational quasi-probability distributions on a classically meaningful representation space. Here, as suggested by the relevant Weyl symbols, the latter is the configuration space of the polar angles. Hence, one is led, by mapping the reduced density matrix equation onto that space, to a master equation for the quasi-probability evolution akin to the Fokker-Planck equation which may be solved in a similar way. Thus, one may study in a classical-like manner the evolution of observables with spin number ranging from an elementary spin to molecular clusters to the classical limit, viz. a nanoparticle. The entire discussion hinges on the one-to-one correspondence between polarization operators in Hilbert space and the spherical harmonics allied to concepts of spin coherent states long familiar in quantum optics.Catering for the reader with only a passing knowledge of statistical and quantum mechanics, the book serves as an introductory text on a complicated subject where the literature is remarkably sparse.

Continuum Models for Phase Transitions and Twinning in Crystals presents the fundamentals of a remarkably successful approach to crystal thermomechanics. Developed over the last two decades, it is based on the mathematical theory of nonlinear thermoelasticity, in which a new viewpoint on material symmetry, motivated by molecular theories, plays a central role.

This is the first organized presentation of a nonlinear elastic approach to twinning and displacive phase transition in crystalline solids. The authors develop geometry, kinematics, and energy invariance in crystals in strong connection and with the purpose of investigating the actual mechanical aspects of the phenomena, particularly in an elastostatics framework based on the minimization of a thermodynamic potential. Interesting for both mechanics and mathematical analysis, the new theory offers the possibility of investigating the formation of microstructures in materials undergoing martensitic phase transitions, such as shape-memory alloys.

Although phenomena such as twinning and phase transitions were once thought to fall outside the range of elastic models, research efforts in these areas have proved quite fruitful. Relevant to a variety of disciplines, including mathematical physics, continuum mechanics, and materials science, Continuum Models for Phase Transitions and Twinning in Crystals is your opportunity to explore these current research methods and topics.

Providing a detailed and pedagogical account of the rapidly-growing field of computational statistical physics, this book covers both the theoretical foundations of equilibrium and non-equilibrium statistical physics, and also modern, computational applications such as percolation, random walks, magnetic systems, machine learning dynamics, and spreading processes on complex networks. A detailed discussion of molecular dynamics simulations is also included, a topic of great importance in biophysics and physical chemistry. The accessible and self-contained approach adopted by the authors makes this book suitable for teaching courses at graduate level, and numerous worked examples and end of chapter problems allow students to test their progress and understanding.

Radio telescopes as well as communication antennas operate under the influence of gravity, temperature and wind. Among those, temperature influences may degrade the performance of a radio telescope through transient changes of the focus, pointing, path length and sensitivity, often in an unpredictable way. Thermal Design and Thermal Behaviour of Radio Telescopes and their Enclosures reviews the design and construction principles of radio telescopes in view of thermal aspects and heat transfer with the variable thermal environment; it explains supporting thermal model calculations and the application and efficiency of thermal protection and temperature control; it presents many measurements illustrating the thermal behaviour of telescopes in the environment of their observatory sites.

The book benefits scientists and radio/communication engineers, telescope designers and construction firms as well as telescope operators, observatory staff, but also the observing astronomer who is directly confronted with the thermal behaviour of a telescope.

This book presents the Proceedings of the 54th Winter School of Theoretical Physics on Simplicity of Complexity in Economic and Social Systems, held in Ladek Zdroj, Poland, from 18 to 24 February 2018. The purpose of the book is to introduce the new interdisciplinary research that links statistical physics, and particular attention is given to link physics of complex systems, with financial analysis and sociology. The main tools used in these areas are numerical simulation of agents behavior and the interpretation of results with the help of complexity methods, therefore a background in statistical physics and in physics of phase transition is necessary to take the first steps towards these research fields called econophysics and sociophysics. In this perspective, the book is intended to graduated students and young researchers who want to begin the study of this established new area, which connects physicists, economists, sociologists and IT professionals, to better understand complexity phenomena existing not only in physics but also in complex systems being seemingly far from traditional view at physics.

This book is dedicated to the atmosphere of our planet, and discusses historical and contemporary achievements in meteorological science and technology for the betterment of society. The book explores many significant atmospheric phenomena and physical processes from the local to global scale, as well as from the perspective of short and long-term time scales, and links these processes to various applications in other scientific disciplines with linkages to meteorology. In addition to addressing general topics such as climate system dynamics and climate change, the book also discusses atmospheric boundary layer, atmospheric waves, atmospheric chemistry, optics/photometeors, electricity, atmospheric modeling and numeric weather prediction. Through its interdisciplinary approach, the book will be of interest to researchers, students and academics in meteorology and atmospheric science, environmental physics, climate change dynamics, air pollution and human health impacts of atmospheric aerosols.

This book intends to introduce some recent results on passivity of complex dynamical networks with single weight and multiple weights. The book collects novel research ideas and some definitions in complex dynamical networks, such as passivity, output strict passivity, input strict passivity, finite-time passivity, and multiple weights. Furthermore, the research results previously published in many flagship journals are methodically edited and presented in a unified form. The book is likely to be of interest to university researchers and graduate students in Engineering and Mathematics who wish to study the passivity of complex dynamical networks.

This book presents mainly studies on the calculation methods of thermal radiative properties of uniaxial anisotropic materials, unidirectional transmission, ultrabroadband perfect absorption, and near-field radiative heat transfer with uniaxial anisotropic materials. The results obtained in this book can not only deepen our understanding of the thermal radiative properties of anisotropic materials, but also have important theoretical guiding significance in energy conversion, energy-saving technology, and design of novel devices.

This book advances systems thinking by introducing a new philosophy of systemic knowing. It argues that there are inescapable limits to rational understanding. Humankind has always depended on extended ways of knowing to complement the rational-analytic approach. The book establishes that the application of such methods is fundamental to systemic practice. The author advocates embracing two modes of consciousness: intentionality, which Western philosophy has long recognized, and non-intentional awareness, which Eastern philosophy additionally highlights. The simultaneity of these two modes of consciousness, and the variety of knowings they spawn are harnessed for a more holistic, systemic knowing. Four practices from fields related to systems thinking are examined: two contemporary action research methodologies from the US and the UK; the Sumedhian (Indian) approach to inquiry about processes within groups; and a technique of group psychotherapy originating in Eastern Europe. Each of these systematically harnesses knowing using both modes of consciousness. Therefore, the author insists, such approaches must be included in systemic practice, in purposeful and methodical juxtaposition to rational-analytic ways. The book provides examples and guidelines for deployment. "All researchers and practitioners of systems thinking and action research must read this book...Raghav has craftfully blended Eastern and Western wisdom. He uses his immersion into Eastern ways of knowing practically, to elaborate the systems philosophy in rich detail. He has incorporated, from cooperative inquiry as action research, the idea of four ways of knowing: practical, propositional, presentational and experiential, to bolster the foundations of systems thinking" SHANKAR SANKARAN, Professor, University of Technology Sydney, Australia; President International Society of Systems Sciences (ISSS) 2019-2020 "This is a book with the potential to stimulate the emergence of a new paradigm. Raghav shows that systems thinking can transcend rational analysis and incorporate other ways of knowing, such as arts-based methods... also, rather than be overly preoccupied with striving for change, there is value in simply abiding, which comes with a deep appreciation of the ecological relationships we are part of. It's not that rational analysis is wrong - it's that it is only part of a genuinely transformative practice". GERALD MIDGLEY, Co-Director, Centre for Systems Studies, University of Hull; former President, ISSS (2013-14) "Raghav Rajagopalan's writing on generating deep appreciation for the social and ecological interdependencies ties in closely with my own work. The philosophical ideas he develops contain the tracings and essential tones of Gregory Bateson's idea of "Mind" as a process of living complexities reaching well beyond the notion of the body. This book demonstrates outstanding erudition and deep compassion at the same time. It should delight the adventurous reader unafraid of big questions". NORA BATESON, President of the International Bateson Institute

Our original objective in writing this book was to demonstrate how the concept of the equation of motion of a Brownian particle - the Langevin equation or Newtonian-like evolution equation of the random phase space variables describing the motion - first formulated by Langevin in 1908 - so making him inter alia the founder of the subject of stochastic differential equations, may be extended to solve the nonlinear problems arising from the Brownian motion in a potential. Such problems appear under various guises in many diverse applications in physics, chemistry, biology, electrical engineering, etc. However, they have been invariably treated (following the original approach of Einstein and Smoluchowski) via the Fokker-Planck equation for the evolution of the probability density function in phase space. Thus the more simple direct dynamical approach of Langevin which we use and extend here, has been virtually ignored as far as the Brownian motion in a potential is concerned. In addition two other considerations have driven us to write this new edition of The Langevin Equation. First, more than five years have elapsed since the publication of the third edition and following many suggestions and comments of our colleagues and other interested readers, it became increasingly evident to us that the book should be revised in order to give a better presentation of the contents. In particular, several chapters appearing in the third edition have been rewritten so as to provide a more direct appeal to the particular community involved and at the same time to emphasize via a synergetic approach how seemingly unrelated physical problems all involving random noise may be described using virtually identical mathematical methods. Secondly, in that period many new and exciting developments have occurred in the application of the Langevin equation to Brownian motion. Consequently, in order to accommodate all these, a very large amount of new material has been added so as to present a comprehensive overview of the subject.