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Chemical Thermodynamics and Information Theory with Applications

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Release : 2011-06-07
Genre : Science
Kind : eBook
Book Rating : 880/5 ( reviews)

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Book Synopsis Chemical Thermodynamics and Information Theory with Applications by : Daniel J. Graham

Download or read book Chemical Thermodynamics and Information Theory with Applications written by Daniel J. Graham. This book was released on 2011-06-07. Available in PDF, EPUB and Kindle. Book excerpt: Thermodynamics and information touch theory every facet of chemistry. However, the physical chemistry curriculum digested by students worldwide is still heavily skewed toward heat/work principles established more than a century ago. Rectifying this situation, Chemical Thermodynamics and Information Theory with Applications explores applications dra

Chemical Thermodynamics

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Release : 2019-11-11
Genre : Technology & Engineering
Kind : eBook
Book Rating : 70X/5 ( reviews)

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Book Synopsis Chemical Thermodynamics by : W.J. Rankin

Download or read book Chemical Thermodynamics written by W.J. Rankin. This book was released on 2019-11-11. Available in PDF, EPUB and Kindle. Book excerpt: This book develops the theory of chemical thermodynamics from first principles, demonstrates its relevance across scientific and engineering disciplines, and shows how thermodynamics can be used as a practical tool for understanding natural phenomena and developing and improving technologies and products. Concepts such as internal energy, enthalpy, entropy, and Gibbs energy are explained using ideas and experiences familiar to students, and realistic examples are given so the usefulness and pervasiveness of thermodynamics becomes apparent. The worked examples illustrate key ideas and demonstrate important types of calculations, and the problems at the end of chapters are designed to reinforce important concepts and show the broad range of applications. Most can be solved using digitized data from open access databases and a spreadsheet. Answers are provided for the numerical problems. A particular theme of the book is the calculation of the equilibrium composition of systems, both reactive and non-reactive, and this includes the principles of Gibbs energy minimization. The overall approach leads to the intelligent use of thermodynamic software packages but, while these are discussed and their use demonstrated, they are not the focus of the book, the aim being to provide the necessary foundations. Another unique aspect is the inclusion of three applications chapters: heat and energy aspects of processing; the thermodynamics of metal production and recycling; and applications of electrochemistry. This book is aimed primarily at students of chemistry, chemical engineering, applied science, materials science, and metallurgy, though it will be also useful for students undertaking courses in geology and environmental science. A solutions manual is available for instructors.

Information Theory of Molecular Systems

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Release : 2006-03-31
Genre : Science
Kind : eBook
Book Rating : 749/5 ( reviews)

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Book Synopsis Information Theory of Molecular Systems by : Roman F Nalewajski

Download or read book Information Theory of Molecular Systems written by Roman F Nalewajski. This book was released on 2006-03-31. Available in PDF, EPUB and Kindle. Book excerpt: As well as providing a unified outlook on physics, Information Theory (IT) has numerous applications in chemistry and biology owing to its ability to provide a measure of the entropy/information contained within probability distributions and criteria of their information "distance" (similarity) and independence. Information Theory of Molecular Systems applies standard IT to classical problems in the theory of electronic structure and chemical reactivity. The book starts by introducing the basic concepts of modern electronic structure/reactivity theory based upon the Density Functional Theory (DFT), followed by an outline of the main ideas and techniques of IT, including several illustrative applications to molecular systems. Coverage includes information origins of the chemical bond, unbiased definition of molecular fragments, adequate entropic measures of their internal (intra-fragment) and external (inter-fragment) bond-orders and valence-numbers, descriptors of their chemical reactivity, and information criteria of their similarity and independence. Information Theory of Molecular Systems is recommended to graduate students and researchers interested in fresh ideas in the theory of electronic structure and chemical reactivity. ·Provides powerful tools for tackling both classical and new problems in the theory of the molecular electronic structure and chemical reactivity·Introduces basic concepts of the modern electronic structure/reactivity theory based upon the Density Functional Theory (DFT)·Outlines main ideas and techniques of Information Theory

Thermodynamics

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Release : 2019-10-15
Genre : Science
Kind : eBook
Book Rating : 760/5 ( reviews)

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Book Synopsis Thermodynamics by : Antonio Saggion

Download or read book Thermodynamics written by Antonio Saggion. This book was released on 2019-10-15. Available in PDF, EPUB and Kindle. Book excerpt: This book offers a comprehensive overview of thermodynamics. It is divided into four parts, the first of which equips readers with a deeper understanding of the fundamental principles of thermodynamics of equilibrium states and of their evolution. The second part applies these principles to a series of generalized situations, presenting applications that are of interest both in their own right and in terms of demonstrating how thermodynamics, as a theory of principle, relates to different fields. In turn, the third part focuses on non-equilibrium configurations and the dynamics of natural processes. It discusses both discontinuous and continuous systems, highlighting the interference among non-equilibrium processes, and the nature of stationary states and of fluctuations in isolated systems. Lastly, part four introduces the relation between physics and information theory, which constitutes a new frontier in fundamental research. The book includes step-by-step exercises, with solutions, to help readers to gain a fuller understanding of the subjects, and also features a series of appendices providing useful mathematical formulae. Reflecting the content of modern university courses on thermodynamics, it is a valuable resource for students and young scientists in the fields of physics, chemistry, and engineering.

Information Theory and Selected Applications

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Release : 2023-01-01
Genre : Computers
Kind : eBook
Book Rating : 762/5 ( reviews)

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Book Synopsis Information Theory and Selected Applications by : Arieh Ben-Naim

Download or read book Information Theory and Selected Applications written by Arieh Ben-Naim. This book was released on 2023-01-01. Available in PDF, EPUB and Kindle. Book excerpt: This book focuses on analysing the applications of the Shannon Measure of Information (SMI). The book introduces the concept of frustration and discusses the question of the quantification of this concept within information theory (IT), while it also focuses on the interpretation of the entropy of systems of interacting particles in terms of the SMI and of mutual information. The author examines the question of the possibility of measuring the extent of frustration using mutual information and discusses some classical examples of processes of mixing and assimilation for which the entropy changes are interpreted in terms of SMI. A description of a few binding systems and the interpretation of cooperativity phenomena in terms of mutual information are also presented, along with a detailed discussion on the general method of using maximum SMI in order to find the “best-guess” probability distribution. This book is a valuable contribution to the field of information theory and will be of great interest to any scientist who is interested in IT and in its potential applications.

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