Principles Of Classical Thermodynamics: Applied To Materials Science


Book Description

The aim of this book is to present Classical Thermodynamics in a unified way, from the most fundamental principles to non-uniform systems, thereby requiring the introduction of coarse graining methods, leading for instance to phase field methods. Solutions thermodynamics and temperature-concentration phase diagrams are covered, plus also a brief introduction to statistical thermodynamics and topological disorder. The Landau theory is included along with a general treatment of multicomponent instabilities in various types of thermodynamic applications, including phase separation and order-disorder transitions. Nucleation theory and spinodal decomposition are presented as extreme cases of a single approach involving the all-important role of fluctuations.In this way, it is hoped that this coverage will reconcile in a unified manner techniques generally presented separately in physics and materials texts.




Principles of Thermodynamics


Book Description

An introductory textbook presenting the key concepts and applications of thermodynamics, including numerous worked examples and exercises.




Molecular Dynamics Simulations in Statistical Physics: Theory and Applications


Book Description

This book presents computer simulations using molecular dynamics techniques in statistical physics, with a focus on macromolecular systems. The numerical methods are introduced in the form of computer algorithms and can be implemented in computers using any desired computer programming language, such as Fortran 90, C/C++, and others. The book also explains how some of these numerical methods and their algorithms can be implemented in the existing computer programming software of macromolecular systems, such as the CHARMM program. In addition, it examines a number of advanced concepts of computer simulation techniques used in statistical physics as well as biological and physical systems. Discussing the molecular dynamics approach in detail to enhance readers understanding of the use of this method in statistical physics problems, it also describes the equations of motion in various statistical ensembles to mimic real-world experimental conditions. Intended for graduate students and research scientists working in the field of theoretical and computational biophysics, physics and chemistry, the book can also be used by postgraduate students of other disciplines, such as applied mathematics, computer sciences, and bioinformatics. Further, offering insights into fundamental theory, it as a valuable resource for expert practitioners and programmers and those new to the field.




Classical Thermodynamics of Fluid Systems


Book Description

This text explores the connections between different thermodynamic subjects related to fluid systems. Emphasis is placed on the clarification of concepts by returning to the conceptual foundation of thermodynamics and special effort is directed to the use of a simple nomenclature and algebra. The book presents the structural elements of classical thermodynamics of fluid systems, covers the treatment of mixtures, and shows via examples and references both the usefulness and the limitations of classical thermodynamics for the treatment of practical problems related to fluid systems. It also includes diverse selected topics of interest to researchers and advanced students and four practical appendices, including an introduction to material balances and step-by-step procedures for using the Virial EOS and the PRSV EOS for fugacities and the ASOG-KT group method for activity coefficients. The Olivera-Fuentes table of PRSV parameters for more than 800 chemical compounds and the Gmehling-Tochigi tables of ASOG interaction parameters for 43 groups are included.




Lectures in Classical Thermodynamics with an Introduction to Statistical Mechanics


Book Description

This textbook facilitates students’ ability to apply fundamental principles and concepts in classical thermodynamics to solve challenging problems relevant to industry and everyday life. It also introduces the reader to the fundamentals of statistical mechanics, including understanding how the microscopic properties of atoms and molecules, and their associated intermolecular interactions, can be accounted for to calculate various average properties of macroscopic systems. The author emphasizes application of the fundamental principles outlined above to the calculation of a variety of thermodynamic properties, to the estimation of conversion efficiencies for work production by heat interactions, and to the solution of practical thermodynamic problems related to the behavior of non-ideal pure fluids and fluid mixtures, including phase equilibria and chemical reaction equilibria. The book contains detailed solutions to many challenging sample problems in classical thermodynamics and statistical mechanics that will help the reader crystallize the material taught. Class-tested and perfected over 30 years of use by nine-time Best Teaching Award recipient Professor Daniel Blankschtein of the Department of Chemical Engineering at MIT, the book is ideal for students of Chemical and Mechanical Engineering, Chemistry, and Materials Science, who will benefit greatly from in-depth discussions and pedagogical explanations of key concepts. Distills critical concepts, methods, and applications from leading full-length textbooks, along with the author’s own deep understanding of the material taught, into a concise yet rigorous graduate and advanced undergraduate text; Enriches the standard curriculum with succinct, problem-based learning strategies derived from the content of 50 lectures given over the years in the Department of Chemical Engineering at MIT; Reinforces concepts covered with detailed solutions to illuminating and challenging homework problems.




The Entropy Principle


Book Description

Entropy – the key concept of thermodynamics, clearly explained and carefully illustrated. This book presents an accurate definition of entropy in classical thermodynamics which does not “put the cart before the horse” and is suitable for basic and advanced university courses in thermodynamics. Entropy is the most important and at the same time the most difficult term of thermodynamics to understand. Many students are discontent with its classical definition since it is either based on “temperature” and “heat” which both cannot be accurately defined without entropy, or since it includes concepts such as “molecular disorder” which does not fit in a macroscopic theory. The physicists Elliott Lieb and Jakob Yngvason have recently developed a new formulation of thermodynamics which is free of these problems. The Lieb-Yngvason formulation of classical thermodynamics is based on the concept of adiabatic accessibility and culminates in the entropy principle. The entropy principle represents the accurate mathematical formulation of the second law of thermodynamics. Temperature becomes a derived quantity whereas ”heat” is no longer needed. This book makes the Lieb-Yngvason theory accessible to students. The presentation is supplemented by seven illustrative examples which explain the application of entropy and the entropy principle in practical problems in science and engineering.




Thermodynamics


Book Description

Thermodynamics is a self-contained analysis of physical and chemical processes, based on classical thermodynamic principles. Emphasis is placed on the fundamental principles, with a conbination of theory and practice, and demonstrating their application to a variety of disciplines. Included in this work are new approaches to irreversible processes, electromagnetic effects, adsorption phenomena, self-assembly, the origin of phase diagrams, critical phenomena, and Carathéodory's treatment of the second law. This book will appeal to graduate students and professional chemists and physicists who wish to acquire a more sophisticated overview of thermodynamics and related subject matter. Easy-to-understand style appeals to both chemists and physicists Discusses treatment of electromagnetic phenomena and adsorption of surface gases surfaces Extensively revised to cater for advanced courses in thermodynamics




The Second Law


Book Description




Elements of Classical Thermodynamics:For Advanced Students of Physics


Book Description

The laws of thermodynamics are amongst the most assured and wide-ranging of all scientific laws. They do not pretend to explain any observation in molecular terms but, by showing the necessary relationships between different physical properties, they reduce otherwise disconnected results to compact order, and predict new effects. This classic title, first published in 1957, is a systematic exposition of principles, with examples of applications, especially to changes of places and the conditions for stability. In all this entropy is a key concept.




Introduction to Thermodynamics and Kinetic Theory of Matter


Book Description

Imparts the similarities and differences between ratified and condensed matter, classical and quantum systems as well as real and ideal gases. Presents the quasi-thermodynamic theory of gas-liquid interface and its application for density profile calculation within the van der Waals theory of surface tension. Uses inductive logic to lead readers from observation and facts to personal interpretation and from specific conclusions to general ones.