Elementary Methods Of Molecular Quantum Mechanics

Download Elementary Methods Of Molecular Quantum Mechanics full books in PDF, epub, and Kindle. Read online Elementary Methods Of Molecular Quantum Mechanics ebook anywhere anytime directly on your device. Fast Download speed and no annoying ads. We cannot guarantee that every ebooks is available!

Elementary Methods of Molecular Quantum Mechanics

Author : Valerio Magnasco
Publisher : Elsevier
ISBN 13 : 008046680X
Total Pages : 750 pages
Book Rating : 4.0/5 (84 download)

DOWNLOAD NOW!

Book Synopsis Elementary Methods of Molecular Quantum Mechanics by : Valerio Magnasco

Download or read book Elementary Methods of Molecular Quantum Mechanics written by Valerio Magnasco and published by Elsevier. This book was released on 2006-12-20 with total page 750 pages. Available in PDF, EPUB and Kindle. Book excerpt: Elementary Methods of Molecular Quantum Mechanics shows the methods of molecular quantum mechanics for graduate University students of Chemistry and Physics. This readable book teaches in detail the mathematical methods needed to do working applications in molecular quantum mechanics, as a preliminary step before using commercial programmes doing quantum chemistry calculations.This book aims to bridge the gap between the classic Coulson’s Valence, where application of wave mechanical principles to valence theory is presented in a fully non-mathematical way, and McWeeny’s Methods of Molecular Quantum Mechanics, where recent advances in the application of quantum mechanical methods to molecular problems are presented at a research level in a full mathematical way. Many examples and mathematical points are given as problems at the end of each chapter, with a hint for their solution. Solutions are then worked out in detail in the last section of each Chapter. * Uses clear and simplified examples to demonstrate the methods of molecular quantum mechanics * Simplifies all mathematical formulae for the reader* Provides educational training in basic methodology

Methods of Molecular Quantum Mechanics

Author : R. McWeeny
Publisher :
ISBN 13 :
Total Pages : 318 pages
Book Rating : 4.:/5 (319 download)

DOWNLOAD NOW!

Book Synopsis Methods of Molecular Quantum Mechanics by : R. McWeeny

Download or read book Methods of Molecular Quantum Mechanics written by R. McWeeny and published by . This book was released on 1969 with total page 318 pages. Available in PDF, EPUB and Kindle. Book excerpt: The last twenty years have seen remarkable advances in molecular quantum mechanics. The traditional methods expounded in the first successful edition of this book have been implemented on a grand scale. In the Second Edition, McWeeny has completely revised the text and has added a wealth of new material and example problems. Key Features * Self-contained development of modern quantum theory of molecular electronic structure and properties * Assumes only an elementary quantum mechanics background * Mathematical methods (vector spaces, representations, group theory, etc.) built up as required * Latest advances (use of second quantization, unitary group, propagators all developed assuming no previous knowledge)

Elementary Molecular Quantum Mechanics

Author : Valerio Magnasco
Publisher : Elsevier
ISBN 13 : 0444626662
Total Pages : 953 pages
Book Rating : 4.4/5 (446 download)

DOWNLOAD NOW!

Book Synopsis Elementary Molecular Quantum Mechanics by : Valerio Magnasco

Download or read book Elementary Molecular Quantum Mechanics written by Valerio Magnasco and published by Elsevier. This book was released on 2013-08-07 with total page 953 pages. Available in PDF, EPUB and Kindle. Book excerpt: The second edition of Elementary Molecular Quantum Mechanics shows the methods of molecular quantum mechanics for graduate University students of Chemistry and Physics. This readable book teaches in detail the mathematical methods needed to do working applications in molecular quantum mechanics, as a preliminary step before using commercial programmes doing quantum chemistry calculations.This book aims to bridge the gap between the classic Coulson’s Valence, where application of wave mechanical principles to valence theory is presented in a fully non-mathematical way, and McWeeny’s Methods of Molecular Quantum Mechanics, where recent advances in the application of quantum mechanical methods to molecular problems are presented at a research level in a full mathematical way. Many examples and mathematical points are given as problems at the end of each chapter, with a hint for their solution. Solutions are then worked out in detail in the last section of each Chapter. Uses clear and simplified examples to demonstrate the methods of molecular quantum mechanics Simplifies all mathematical formulae for the reader Provides educational training in basic methodology

Molecular Quantum Mechanics

Author : Peter W. Atkins
Publisher : Oxford University Press
ISBN 13 : 0199541426
Total Pages : 552 pages
Book Rating : 4.1/5 (995 download)

DOWNLOAD NOW!

Book Synopsis Molecular Quantum Mechanics by : Peter W. Atkins

Download or read book Molecular Quantum Mechanics written by Peter W. Atkins and published by Oxford University Press. This book was released on 2011 with total page 552 pages. Available in PDF, EPUB and Kindle. Book excerpt: This text unravels those fundamental physical principles which explain how all matter behaves. It takes us from the foundations of quantum mechanics, through quantum models of atomic, molecular, and electronic structure, and on to discussions of spectroscopy, and the electronic and magnetic properties of molecules.

Methods of Molecular Quantum Mechanics

Author : Valerio Magnasco
Publisher : John Wiley & Sons
ISBN 13 : 0470684429
Total Pages : 304 pages
Book Rating : 4.4/5 (76 download)

DOWNLOAD NOW!

Book Synopsis Methods of Molecular Quantum Mechanics by : Valerio Magnasco

Download or read book Methods of Molecular Quantum Mechanics written by Valerio Magnasco and published by John Wiley & Sons. This book was released on 2009-12-21 with total page 304 pages. Available in PDF, EPUB and Kindle. Book excerpt: This advanced text introduces to the advanced undergraduate and graduate student the mathematical foundations of the methods needed to carry out practical applications in electronic molecular quantum mechanics, a necessary preliminary step before using commercial programmes to carry out quantum chemistry calculations. Major features of the book include: Consistent use of the system of atomic units, essential for simplifying all mathematical formulae Introductory use of density matrix techniques for interpreting properties of many-body systems An introduction to valence bond methods with an explanation of the origin of the chemical bond A unified presentation of basic elements of atomic and molecular interactions The book is intended for advanced undergraduate and first-year graduate students in chemical physics, theoretical and quantum chemistry. In addition, it is relevant to students from physics and from engineering sub-disciplines such as chemical engineering and materials sciences.

Methods of Molecular Quantum Mechanics

Author : R. McWeeny
Publisher :
ISBN 13 :
Total Pages : 598 pages
Book Rating : 4.:/5 (318 download)

DOWNLOAD NOW!

Book Synopsis Methods of Molecular Quantum Mechanics by : R. McWeeny

Download or read book Methods of Molecular Quantum Mechanics written by R. McWeeny and published by . This book was released on 1989 with total page 598 pages. Available in PDF, EPUB and Kindle. Book excerpt: Since this book was first published 20 years ago, there have been remarkable advances in molecular quantum mechanics. The traditional methods expounded in the first edition have been absorbed into thegrowing field of "computational chemistry": but the whole fabric of the subject has also changed under the impact of techniques originating in theoretical physics. Consequently, besides rewriting much of the original text, it has been necessary to add an almost equal amount of completely new material: this covers second quantization and diagrammatic perturbation theory,symmetric and unitary group methods, new forms of valence bond theory, dynamic properties and response, propagator and equation-of-motiontechniques and the theory of intermolecular forces. Problems (withhints on solutions) appear at the end of each chapter and form a valuable supplement to the text. Like the first edition, this is a "teaching book" which follows a deductive step-by-step path from basic principles up to the current frontiers of research. Although aimed primarily at graduate students and their teachers, it should be standard reference for all who come in contact with modern theories of the electronic structure and properties of molecules. The last twenty years have seen remarkable advances in molecular quantum mechanics. The traditional methods expounded in the first successful edition of this book have been implemented on a grand scale. In the Second Edition, Mcweeny has completly revised the text and has added a wealth of new material and example problems.

Methods of Molecular Quantum Mechanics

Author : Valerio Magnasco
Publisher : John Wiley & Sons
ISBN 13 : 0470684542
Total Pages : 299 pages
Book Rating : 4.4/5 (76 download)

DOWNLOAD NOW!

Book Synopsis Methods of Molecular Quantum Mechanics by : Valerio Magnasco

Download or read book Methods of Molecular Quantum Mechanics written by Valerio Magnasco and published by John Wiley & Sons. This book was released on 2009-10-29 with total page 299 pages. Available in PDF, EPUB and Kindle. Book excerpt: Methods of Molecular Quantum Mechanics This advanced text introduces to the advanced undergraduate and graduate student the mathematical foundations of the methods needed to carry out practical applications in electronic molecular quantum mechanics, a necessary preliminary step before using commercial programmes to carry out quantum chemistry calculations. Major features of the book include: Consistent use of the system of atomic units, essential for simplifying all mathematical formulae Introductory use of density matrix techniques for interpreting properties of many-body systems An introduction to valence bond methods with an explanation of the origin of the chemical bond A unified presentation of basic elements of atomic and molecular interactions The book is intended for advanced undergraduate and first-year graduate students in chemical physics, theoretical and quantum chemistry. In addition, it is relevant to students from physics and from engineering sub-disciplines such as chemical engineering and materials sciences.

Molecular Quantum Dynamics

Author : Fabien Gatti
Publisher : Springer Science & Business Media
ISBN 13 : 3642452906
Total Pages : 281 pages
Book Rating : 4.6/5 (424 download)

DOWNLOAD NOW!

Book Synopsis Molecular Quantum Dynamics by : Fabien Gatti

Download or read book Molecular Quantum Dynamics written by Fabien Gatti and published by Springer Science & Business Media. This book was released on 2014-04-09 with total page 281 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book focuses on current applications of molecular quantum dynamics. Examples from all main subjects in the field, presented by the internationally renowned experts, illustrate the importance of the domain. Recent success in helping to understand experimental observations in fields like heterogeneous catalysis, photochemistry, reactive scattering, optical spectroscopy, or femto- and attosecond chemistry and spectroscopy underline that nuclear quantum mechanical effects affect many areas of chemical and physical research. In contrast to standard quantum chemistry calculations, where the nuclei are treated classically, molecular quantum dynamics can cover quantum mechanical effects in their motion. Many examples, ranging from fundamental to applied problems, are known today that are impacted by nuclear quantum mechanical effects, including phenomena like tunneling, zero point energy effects, or non-adiabatic transitions. Being important to correctly understand many observations in chemical, organic and biological systems, or for the understanding of molecular spectroscopy, the range of applications covered in this book comprises broad areas of science: from astrophysics and the physics and chemistry of the atmosphere, over elementary processes in chemistry, to biological processes (such as the first steps of photosynthesis or vision). Nevertheless, many researchers refrain from entering this domain. The book "Molecular Quantum Dynamics" offers them an accessible introduction. Although the calculation of large systems still presents a challenge - despite the considerable power of modern computers - new strategies have been developed to extend the studies to systems of increasing size. Such strategies are presented after a brief overview of the historical background. Strong emphasis is put on an educational presentation of the fundamental concepts, so that the reader can inform himself about the most important concepts, like eigenstates, wave packets, quantum mechanical resonances, entanglement, etc. The chosen examples highlight that high-level experiments and theory need to work closely together. This book thus is a must-read both for researchers working experimentally or theoretically in the concerned fields, and generally for anyone interested in the exciting world of molecular quantum dynamics.

Basic Principles and Techniques of Molecular Quantum Mechanics

Author : Ralph E. Christoffersen
Publisher : Springer Science & Business Media
ISBN 13 : 1468463608
Total Pages : 698 pages
Book Rating : 4.4/5 (684 download)

DOWNLOAD NOW!

Book Synopsis Basic Principles and Techniques of Molecular Quantum Mechanics by : Ralph E. Christoffersen

Download or read book Basic Principles and Techniques of Molecular Quantum Mechanics written by Ralph E. Christoffersen and published by Springer Science & Business Media. This book was released on 2013-03-08 with total page 698 pages. Available in PDF, EPUB and Kindle. Book excerpt: New textbooks at all levels of chemistry appear with great regularity. Some fields like basic biochemistry, organic reaction mechanisms, and chemical thermody namics are well represented by many excellent texts, and new or revised editions are published sufficiently often to keep up with progress in research. However, some areas of chemistry, especially many of those taught at the graduate level, suffer from a real lack of up-to-date textbooks. The most serious needs occur in fields that are rapidly changing. Textbooks in these subjects usually have to be written by scientists actually involved in the research which is advancing the field. It is not often easy to persuade such individuals to set time aside to help spread the knowledge they have accumulated. Our goal, in this series, is to pinpoint areas of chemistry where recent progress has outpaced what is covered in any available textbooks, and then seek out and persuade experts in these fields to produce relatively concise but instructive introductions to their fields. These should serve the needs of one semester or one quarter graduate courses in chemistry and biochemistry. In some cases, the availability of texts in active research areas should help stimulate the creation of new courses. New York, New York CHARLES R. CANTOR Preface This book is not a traditional quantum chemistry textbook. Instead, it represents a concept that has evolved from teaching graduate courses in quantum chemistry over a number of years, and encountering students with diverse backgrounds.

Elementary Quantum Chemistry, Second Edition

Author : Frank L. Pilar
Publisher : Courier Corporation
ISBN 13 : 0486143872
Total Pages : 646 pages
Book Rating : 4.4/5 (861 download)

DOWNLOAD NOW!

Book Synopsis Elementary Quantum Chemistry, Second Edition by : Frank L. Pilar

Download or read book Elementary Quantum Chemistry, Second Edition written by Frank L. Pilar and published by Courier Corporation. This book was released on 2013-08-22 with total page 646 pages. Available in PDF, EPUB and Kindle. Book excerpt: As the author notes in the Preface to this valuable text, experimental chemists have moved past studying the average behavior of atoms or molecules "to probe the step-by-step behavior of individual atoms and molecules as they collide, form 'transition states,' and ultimately form products." In such experiments, quantum mechanical computations do two useful tasks: They fill in the observational gaps and help to interpret what has been observed. This introductory course — developed by the former chairman of the chemistry department at the University of New Hampshire — covers, among other topics, the origins of the quantum theory, the Schrödinger wave equation, the quantum mechanics of simple systems, the rigid rotator, the hydrogen atom, electron spin and many-electron systems, the quantum states of atoms, the Hartree-Fock self-consistent field method, the electronic structure of molecules, and semi-empirical molecular orbital methods. One of the great values of the course is its calculations and diagrams, which were created specifically for this text and which students will be able to replicate on their home computers. The text will be most useful for advanced undergraduate or beginning graduate students who have had calculus and at least a year of undergraduate physics. A knowledge of differential equations, linear algebra, and atomic physics is helpful but not essential. Seven appendices give a concise exposition of mathematical and physical material that may not be part of the students' background.

Elementary Quantum Chemistry

Author : Frank L. Pilar
Publisher : Courier Corporation
ISBN 13 : 9780486414645
Total Pages : 646 pages
Book Rating : 4.4/5 (146 download)

DOWNLOAD NOW!

Book Synopsis Elementary Quantum Chemistry by : Frank L. Pilar

Download or read book Elementary Quantum Chemistry written by Frank L. Pilar and published by Courier Corporation. This book was released on 2001-01-01 with total page 646 pages. Available in PDF, EPUB and Kindle. Book excerpt: Useful introductory course and reference covers origins of quantum theory, Schrödinger wave equation, quantum mechanics of simple systems, electron spin, quantum states of atoms, Hartree-Fock self-consistent field method, more. 1990 edition.

Methods of Molecular Quantum Mechanics

Author : R. McWeeny
Publisher :
ISBN 13 :
Total Pages : 307 pages
Book Rating : 4.:/5 (959 download)

DOWNLOAD NOW!

Book Synopsis Methods of Molecular Quantum Mechanics by : R. McWeeny

Download or read book Methods of Molecular Quantum Mechanics written by R. McWeeny and published by . This book was released on 2000 with total page 307 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Applications of Quantum Dynamics in Chemistry

Author : Fabien Gatti
Publisher : Springer
ISBN 13 : 331953923X
Total Pages : 437 pages
Book Rating : 4.3/5 (195 download)

DOWNLOAD NOW!

Book Synopsis Applications of Quantum Dynamics in Chemistry by : Fabien Gatti

Download or read book Applications of Quantum Dynamics in Chemistry written by Fabien Gatti and published by Springer. This book was released on 2017-09-05 with total page 437 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book explains the usage and application of Molecular Quantum Dynamics, the methodology where both the electrons and the nuclei in a molecule are treated with quantum mechanical calculations. This volume of Lecture Notes in Chemistry addresses graduate students and postdocs in the field of theoretical chemistry, as well as postgraduate students, researchers and teachers from neighboring fields, such as quantum physics, biochemistry, biophysics, or anyone else who is interested in this rising method in theoretical chemistry, and who wants to gain experience in the opportunities it can offer. It can also be useful for teachers interested in illustrative examples of time-dependent quantum mechanics as animations of realistic wave packets have been designed to assist in visualization. Assuming a basic knowledge about quantum mechanics, the authors link their explanations to recent experimental investigations where Molecular Quantum Dynamics proved successful and necessary for the understanding of the experimental results. Examples including reactive scattering, photochemistry, tunneling, femto- and attosecond chemistry and spectroscopy, cold chemistry or crossed-beam experiments illustrate the power of the method. The book restricts complicated formalism to the necessary and in a self-contained and clearly explained way, offering the reader an introduction to, and instructions for, practical exercises. Continuative explanation and math are optionally supplemented for the interested reader. The reader learns how to apply example simulations with the MCTDH program package (Multi Configuration Time Dependent Hartree calculations). Readers can thus obtain the tools to run their own simulations and apply them to their problems. Selected scripts and program code from the examples are made available as supplementary material. This book bridges the gap between the existing textbooks on fundamental theoretical chemistry and research monographs focusing on sophisticated applications. It is a must-read for everyone who wants to gain a sound understanding of Molecular Quantum Dynamics simulations and to obtain basic experience in running their own simulations.

Basic Molecular Quantum Mechanics

Author : Steven A. Adelman
Publisher : CRC Press
ISBN 13 : 1498734006
Total Pages : 464 pages
Book Rating : 4.4/5 (987 download)

DOWNLOAD NOW!

Book Synopsis Basic Molecular Quantum Mechanics by : Steven A. Adelman

Download or read book Basic Molecular Quantum Mechanics written by Steven A. Adelman and published by CRC Press. This book was released on 2021-08-01 with total page 464 pages. Available in PDF, EPUB and Kindle. Book excerpt: Quantum mechanics is a general theory of the motions, structures, properties, and behaviors of particles of atomic and subatomic dimensions. While quantum mechanics was created in the first third of the twentieth century by a handful of theoretical physicists working on a limited number of problems, it has further developed and is now applied by a great number of people working on a vast range of problems in wide areas of science and technology. Basic Molecular Quantum Mechanics introduces quantum mechanics by covering the fundamentals of quantum mechanics and some of its most important chemical applications: vibrational and rotational spectroscopy and electronic structure of atoms and molecules. Thoughtfully organized, the author builds up quantum mechanics systematically with each chapter preparing the student for the more advanced chapters and complex applications. Additional features include the following: This book presents rigorous and precise explanations of quantum mechanics and mathematical proofs. It contains qualitative discussions of key concepts with mathematics presented in the appendices. It provides problems and solutions at the end of each chapter to encourage understanding and application. This book is carefully written to emphasize its applications to chemistry and is a valuable resource for advanced undergraduates and beginning graduate students specializing in chemistry, in related fields such as chemical engineering and materials science, and in some areas of biology.

Elementary Quantum Mechanics

Author : David S. Saxon
Publisher : Courier Corporation
ISBN 13 : 0486310418
Total Pages : 450 pages
Book Rating : 4.4/5 (863 download)

DOWNLOAD NOW!

Book Synopsis Elementary Quantum Mechanics by : David S. Saxon

Download or read book Elementary Quantum Mechanics written by David S. Saxon and published by Courier Corporation. This book was released on 2013-07-24 with total page 450 pages. Available in PDF, EPUB and Kindle. Book excerpt: Based on lectures for an undergraduate UCLA course in quantum mechanics, this volume focuses on the formulas of quantum mechanics rather than applications. Widely used in both upper-level undergraduate and graduate courses, it offers a broad self-contained survey rather than in-depth treatments. Topics include the dual nature of matter and radiation, state functions and their interpretation, linear momentum, the motion of a free particle, Schrödinger's equation, approximation methods, angular momentum, and many other subjects. In the interests of keeping the mathematics as simple as possible, most of the book is confined to considerations of one-dimensional systems. A selection of 150 problems, many of which require prolonged study, amplify the text's teachings and an appendix contains solutions to 50 representative problems. This edition also includes a new Introduction by Joseph A. Rudnick and Robert Finkelstein.

Ideas of Quantum Chemistry

Author : Lucjan Piela
Publisher : Elsevier
ISBN 13 : 0080466761
Total Pages : 1122 pages
Book Rating : 4.0/5 (84 download)

DOWNLOAD NOW!

Book Synopsis Ideas of Quantum Chemistry by : Lucjan Piela

Download or read book Ideas of Quantum Chemistry written by Lucjan Piela and published by Elsevier. This book was released on 2006-11-28 with total page 1122 pages. Available in PDF, EPUB and Kindle. Book excerpt: Ideas of Quantum Chemistry shows how quantum mechanics is applied to chemistry to give it a theoretical foundation. The structure of the book (a TREE-form) emphasizes the logical relationships between various topics, facts and methods. It shows the reader which parts of the text are needed for understanding specific aspects of the subject matter. Interspersed throughout the text are short biographies of key scientists and their contributions to the development of the field.Ideas of Quantum Chemistry has both textbook and reference work aspects. Like a textbook, the material is organized into digestable sections with each chapter following the same structure. It answers frequently asked questions and highlights the most important conclusions and the essential mathematical formulae in the text. In its reference aspects, it has a broader range than traditional quantum chemistry books and reviews virtually all of the pertinent literature. It is useful both for beginners as well as specialists in advanced topics of quantum chemistry. The book is supplemented by an appendix on the Internet. * Presents the widest range of quantum chemical problems covered in one book * Unique structure allows material to be tailored to the specific needs of the reader * Informal language facilitates the understanding of difficult topics

Elementary Quantum Mechanics

Author : R. W Gurney
Publisher : Cambridge University Press
ISBN 13 : 1107586356
Total Pages : 173 pages
Book Rating : 4.1/5 (75 download)

DOWNLOAD NOW!

Book Synopsis Elementary Quantum Mechanics by : R. W Gurney

Download or read book Elementary Quantum Mechanics written by R. W Gurney and published by Cambridge University Press. This book was released on 1934 with total page 173 pages. Available in PDF, EPUB and Kindle. Book excerpt: Originally published in 1934, this reference guide provides introductory and principle knowledge of the theory of quantum mechanics.