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Mathematical Physics In Theoretical Chemistry

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Mathematical Physics in Theoretical Chemistry

Mathematical Physics in Theoretical Chemistry Book
Author : S. M. Blinder,J. E. House
Publisher : Elsevier
Release : 2018-11-26
ISBN : 0128137010
Language : En, Es, Fr & De

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Book Description :

Mathematical Physics in Theoretical Chemistry deals with important topics in theoretical and computational chemistry. Topics covered include density functional theory, computational methods in biological chemistry, and Hartree-Fock methods. As the second volume in the Developments in Physical & Theoretical Chemistry series, this volume further highlights the major advances and developments in research, also serving as a basis for advanced study. With a multidisciplinary and encompassing structure guided by a highly experienced editor, the series is designed to enable researchers in both academia and industry stay abreast of developments in physical and theoretical chemistry. Brings together the most important aspects and recent advances in theoretical and computational chemistry Covers computational methods for small molecules, density-functional methods, and computational chemistry on personal and quantum computers Presents cutting-edge developments in theoretical and computational chemistry that are applicable to graduate students and research professionals in chemistry, physics, materials science and biochemistry

Exam Prep for Mathematical Physics in Theoretical Chemistry

Exam Prep for  Mathematical Physics in Theoretical Chemistry Book
Author : Anonim
Publisher : Unknown
Release : 2020-12-03
ISBN : 0987650XXX
Language : En, Es, Fr & De

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Book Description :

Download Exam Prep for Mathematical Physics in Theoretical Chemistry book written by , available in PDF, EPUB, and Kindle, or read full book online anywhere and anytime. Compatible with any devices.

Exam Prep Flash Cards for Mathematical Physics in

Exam Prep Flash Cards for Mathematical Physics in     Book
Author : Anonim
Publisher : Unknown
Release : 2020-12-03
ISBN : 0987650XXX
Language : En, Es, Fr & De

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Book Description :

Download Exam Prep Flash Cards for Mathematical Physics in book written by , available in PDF, EPUB, and Kindle, or read full book online anywhere and anytime. Compatible with any devices.

Mathematical Physics in Theoretical Chemistry h

Mathematical Physics in Theoretical Chemistry h Book
Author : S. M. Blinder
Publisher : Unknown
Release : 2018
ISBN : 0987650XXX
Language : En, Es, Fr & De

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Book Description :

Download Mathematical Physics in Theoretical Chemistry h book written by S. M. Blinder, available in PDF, EPUB, and Kindle, or read full book online anywhere and anytime. Compatible with any devices.

Chemical Physics and Quantum Chemistry

Chemical Physics and Quantum Chemistry Book
Author : Anonim
Publisher : Academic Press
Release : 2020-10-02
ISBN : 9780128197578
Language : En, Es, Fr & De

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Book Description :

Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field one that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. In this volume the readers are presented with an exciting combination of themes. Presents surveys of current topics in this rapidly-developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biology Features detailed reviews written by leading international researchers Topics include: New advances in Quantum Chemical Physics; Original theory and a contemporary overview of the field of Theoretical Chemical Physics; State-of-the-Art calculations in Theoretical Chemistry

Mathematical Physical Chemistry

Mathematical Physical Chemistry Book
Author : Shu Hotta
Publisher : Springer Nature
Release : 2020-04-10
ISBN : 9811522251
Language : En, Es, Fr & De

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Book Description :

The second edition of this book has been extensively revised so that readers can gain ready access to advanced topics of mathematical physics including the theory of analytic functions and continuous groups. This easy accessibility helps to create a deeper and clearer insight into mathematical physics, with emphasis on quantum mechanics and electromagnetism along with the theory of linear vector spaces and group theory. The basic nature of the book remains unchanged. The contents are targeted at graduate and undergraduate students majoring in chemistry to supply them with the practical and intuitive methodology of mathematical physics. In parallel, advanced mathematical topics are dealt with in the last chapters of each of the four individual parts so that a close connection among those topics is highlighted. Several important revisions are found in this second edition, however, and they include: (a) a description of set theory and topology that helps to comprehend the essence of the theory of analytic functions and continuous groups; (b) a deep connection between angular momenta and continuous groups; (c) development of the theory of exponential functions of matrices, which is useful to solve differential equations; and (d) updated content on lasers and their applications. This new edition thus provides a balanced selection of new and basic material for chemists and physicists.

Advances in Quantum Chemistry

Advances in Quantum Chemistry Book
Author : John R. Sabin,Erkki J. Brändas
Publisher : Academic Press
Release : 2011
ISBN : 012386013X
Language : En, Es, Fr & De

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Book Description :

Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. This series provides a one-stop resource for following progress in this interdisciplinary area. Publishes articles, invited reviews and proceedings of major international conferences and workshops Written by leading international researchers in quantum and theoretical chemistry Highlights important interdisciplinary developments

Variational Principles and Methods in Theoretical Physics and Chemistry

Variational Principles and Methods in Theoretical Physics and Chemistry Book
Author : Robert K. Nesbet
Publisher : Cambridge University Press
Release : 2002-11-14
ISBN : 9781139435697
Language : En, Es, Fr & De

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Book Description :

This book brings together the essential ideas and methods behind applications of variational theory in theoretical physics and chemistry. The emphasis is on understanding physical and computational applications of variational methodology rather than on rigorous mathematical formalism. The text begins with an historical survey of familiar variational principles in classical mechanics and optimization theory, then proceeds to develop the variational principles and formalism behind current computational methodology for bound and continuum quantum states of interacting electrons in atoms, molecules, and condensed matter. It covers multiple-scattering theory, including a detailed presentation of contemporary methodology for electron-impact rotational and vibrational excitation of molecules. The book ends with an introduction to the variational theory of relativistic fields. Ideal for graduate students and researchers in any field that uses variational methodology, this book is particularly suitable as a backup reference for lecture courses in mathematical methods in physics and theoretical chemistry.

Algebraic Methods in Quantum Chemistry and Physics

Algebraic Methods in Quantum Chemistry and Physics Book
Author : Francisco M. Fernandez,E.A. Castro
Publisher : CRC Press
Release : 1995-10-24
ISBN : 9780849382925
Language : En, Es, Fr & De

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Book Description :

Algebraic Methods in Quantum Chemistry and Physics provides straightforward presentations of selected topics in theoretical chemistry and physics, including Lie algebras and their applications, harmonic oscillators, bilinear oscillators, perturbation theory, numerical solutions of the Schrödinger equation, and parameterizations of the time-evolution operator. The mathematical tools described in this book are presented in a manner that clearly illustrates their application to problems arising in theoretical chemistry and physics. The application techniques are carefully explained with step-by-step instructions that are easy to follow, and the results are organized to facilitate both manual and numerical calculations. Algebraic Methods in Quantum Chemistry and Physics demonstrates how to obtain useful analytical results with elementary algebra and calculus and an understanding of basic quantum chemistry and physics.

Neither Physics Nor Chemistry

Neither Physics Nor Chemistry Book
Author : Kōstas Gavroglou,Ana Simões
Publisher : MIT Press
Release : 2012
ISBN : 0262016184
Language : En, Es, Fr & De

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Book Description :

The evolution of a discipline at the intersection of physics, chemistry, and mathematics.

Advances in Quantum Chemistry

Advances in Quantum Chemistry Book
Author : John R. Sabin,Erkki J. Brandas
Publisher : Elsevier
Release : 2006-12-27
ISBN : 0080467393
Language : En, Es, Fr & De

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Book Description :

Advances in Quantum Chemistry presents surveys of current developments in this rapidly developing field that falls between the historically established areas of mathematics, physics, chemistry, and biology. With invited reviews written by leading international researchers, each presenting new results, it provides a single vehicle for following progress in this interdisciplinary area. Advances in Quantum Chemistry, Volume 51 deals with various aspects of mathematical versus chemical applications. Some parts belong to established scientific domains, where technical progress has been crucial for the development of modern quantum chemistry as well as the quantification problem in spectral resonance analysis. The first chapter in the volume, concerns the calculation of molecular electronic structure to high accuracy, using a variety of one and two-body schemes in the coupled cluster family of methods. Chapter 2 is devoted to Angular Momentum Diagrams. In chapters 3 and 4, the autors portray Chemical Graph Theory (CGT). Advances quantum mechanical signal processing through the fast Padé transform (FPT) are covered in Chapter 5. The concluding chapter gives a mathematical view of molecular equilibria using a Density-Functional Theory (DFT) description. Publishes articles, invited reviews and proceedings of major international conferences and workshops Compiled by the leading international researchers in quantum and theoretical chemistry Highlights the important, interdisciplinary developments

Many Electron Approaches in Physics Chemistry and Mathematics

Many Electron Approaches in Physics  Chemistry and Mathematics Book
Author : Volker Bach,Luigi Delle Site
Publisher : Springer
Release : 2014-07-01
ISBN : 3319063790
Language : En, Es, Fr & De

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Book Description :

This book provides a broad description of the development and (computational) application of many-electron approaches from a multidisciplinary perspective. In the context of studying many-electron systems Computer Science, Chemistry, Mathematics and Physics are all intimately interconnected. However, beyond a handful of communities working at the interface between these disciplines, there is still a marked separation of subjects. This book seeks to offer a common platform for possible exchanges between the various fields and to introduce the reader to perspectives for potential further developments across the disciplines. The rapid advances of modern technology will inevitably require substantial improvements in the approaches currently used, which will in turn make exchanges between disciplines indispensable. In essence this book is one of the very first attempts at an interdisciplinary approach to the many-electron problem.

Symmetry Group Theory and Mathematical Treatment in Chemistry

Symmetry  Group Theory  and Mathematical Treatment in Chemistry Book
Author : Takashiro Akitsu
Publisher : BoD – Books on Demand
Release : 2018-07-18
ISBN : 1789233143
Language : En, Es, Fr & De

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Book Description :

The aim of this book Symmetry (Group Theory) and Mathematical Treatment in Chemistry is to be a graduate school-level text about introducing recent research examples associated with symmetry (group theory) and mathematical treatment in inorganic or organic chemistry, physical chemistry or chemical physics, and theoretical chemistry. Chapters contained can be classified into mini-review, tutorial review, or original research chapters of mathematical treatment in chemistry with brief explanation of related mathematical theories. Keywords are symmetry, group theory, crystallography, solid state, topology, molecular structure, electronic state, quantum chemistry, theoretical chemistry, and DFT calculations.

Linear Scaling Techniques in Computational Chemistry and Physics

Linear Scaling Techniques in Computational Chemistry and Physics Book
Author : Robert Zaleśny,Manthos G. Papadopoulos,Paul G. Mezey,Jerzy Leszczynski
Publisher : Springer Science & Business Media
Release : 2011-03-21
ISBN : 9789048128532
Language : En, Es, Fr & De

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Book Description :

"Linear-Scaling Techniques in Computational Chemistry and Physics" summarizes recent progresses in linear-scaling techniques and their applications in chemistry and physics. In order to meet the needs of a broad community of chemists and physicists, the book focuses on recent advances that extended the scope of possible exploitations of the theory. The first chapter provides an overview of the present state of the linear-scaling methodologies and their applications, outlining hot topics in this field, and pointing to expected developments in the near future. This general introduction is then followed by several review chapters written by experts who substantially contributed to recent developments in this field. The purpose of this book is to review, in a systematic manner, recent developments in linear-scaling methods and their applications in computational chemistry and physics. Great emphasis is put on the theoretical aspects of linear-scaling methods. This book serves as a handbook for theoreticians, who are involved in the development of new efficient computational methods as well as for scientists, who are using the tools of computational chemistry and physics in their research.

Mathematics for Chemistry and Physics

Mathematics for Chemistry and Physics Book
Author : George Turrell
Publisher : Elsevier
Release : 2001-12-04
ISBN : 0080511279
Language : En, Es, Fr & De

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Book Description :

Chemistry and physics share a common mathematical foundation. From elementary calculus to vector analysis and group theory, Mathematics for Chemistry and Physics aims to provide a comprehensive reference for students and researchers pursuing these scientific fields. The book is based on the authors many classroom experience. Designed as a reference text, Mathematics for Chemistry and Physics will prove beneficial for students at all university levels in chemistry, physics, applied mathematics, and theoretical biology. Although this book is not computer-based, many references to current applications are included, providing the background to what goes on "behind the screen" in computer experiments.

From Chemical Philosophy to Theoretical Chemistry

From Chemical Philosophy to Theoretical Chemistry Book
Author : Mary Jo Nye
Publisher : Univ of California Press
Release : 1994-03-01
ISBN : 9780520913561
Language : En, Es, Fr & De

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Book Description :

How did chemistry and physics acquire their separate identities, and are they on their way to losing them again? Mary Jo Nye has written a graceful account of the historical demarcation of chemistry from physics and subsequent reconvergences of the two, from Lavoisier and Dalton in the late eighteenth century to Robinson, Ingold, and Pauling in the mid-twentieth century. Using the notion of a disciplinary "identity" analogous to ethnic or national identity, Nye develops a theory of the nature of disciplinary structure and change. She discusses the distinctive character of chemical language and theories and the role of national styles and traditions in building a scientific discipline. Anyone interested in the history of scientific thought will enjoy pondering with her the question of whether chemists of the mid-twentieth century suspected chemical explanation had been reduced to physical laws, just as Newtonian mechanical philosophers had envisioned in the eighteenth century.

Advances in Quantum Chemistry

Advances in Quantum Chemistry Book
Author : Anonim
Publisher : Academic Press
Release : 2013-07-23
ISBN : 0124079067
Language : En, Es, Fr & De

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Book Description :

Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. This volume focuses on the theory of heavy ion physics in medicine. Presents surveys of current topics in this rapidly developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology Features detailed reviews written by leading international researchers Focuses on the theory of heavy ion physics in medicine

Introduction to Quantum Mechanics

Introduction to Quantum Mechanics Book
Author : Sy M. Blinder
Publisher : Elsevier
Release : 2012-12-02
ISBN : 0080489281
Language : En, Es, Fr & De

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Book Description :

Introduction to Quantum Mechanics provides a lucid, up-to-date introduction to the principles of quantum mechanics at the level of undergraduates and first-year graduate students in chemistry, materials science, biology and related fields. It shows how the fundamental concepts of quantum theory arose from classic experiments in physics and chemistry, and presents the quantum-mechanical foundations of modern techniques including molecular spectroscopy, lasers and NMR. Blinder also discusses recent conceptual developments in quantum theory, including Schrödinger's Cat, the Einstein-Podolsky-Rosen experiment, Bell's theorem and quantum computing. Clearly presents the basics of quantum mechanics and modern developments in the field Explains applications to molecular spectroscopy, lasers, NMR, and MRI Introduces new concepts such as Schrödinger's Cat, Bell's Theorem, and quantum computing Includes full-color illustrations, proven pedagogical features, and links to online materials

Computational Chemistry of Solid State Materials

Computational Chemistry of Solid State Materials Book
Author : Richard Dronskowski
Publisher : John Wiley & Sons
Release : 2008-01-08
ISBN : 3527612297
Language : En, Es, Fr & De

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Book Description :

This is the first book to present both classical and quantum-chemical approaches to computational methods, incorporating the many new developments in this field from the last few years. Written especially for "non"-theoretical readers in a readily comprehensible and implemental style, it includes numerous practical examples of varying degrees of difficulty. Similarly, the use of mathematical equations is reduced to a minimum, focusing only on those important for experimentalists. Backed by many extensive tables containing detailed data for direct use in the calculations, this is the ideal companion for all those wishing to improve their work in solid state research.

Mathematical Challenges from Theoretical Computational Chemistry

Mathematical Challenges from Theoretical Computational Chemistry Book
Author : National Research Council,Division on Engineering and Physical Sciences,Commission on Physical Sciences, Mathematics, and Applications,Committee on Mathematical Challenges from Computational Chemistry
Publisher : National Academies Press
Release : 1995-04-29
ISBN : 0309050979
Language : En, Es, Fr & De

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Book Description :

Computational methods are rapidly becoming major tools of theoretical, pharmaceutical, materials, and biological chemists. Accordingly, the mathematical models and numerical analysis that underlie these methods have an increasingly important and direct role to play in the progress of many areas of chemistry. This book explores the research interface between computational chemistry and the mathematical sciences. In language that is aimed at non-specialists, it documents some prominent examples of past successful cross-fertilizations between the fields and explores the mathematical research opportunities in a broad cross-section of chemical research frontiers. It also discusses cultural differences between the two fields and makes recommendations for overcoming those differences and generally promoting this interdisciplinary work.