Advanced Molecular Quantum Mechanics

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Advanced Molecular Quantum Mechanics

Author : R. Moss
Publisher : Springer Science & Business Media
Page : 300 pages
File Size : 41,6 Mb
Release : 2012-12-06
Category : Science
ISBN : 9789400956889

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Advanced Molecular Quantum Mechanics by R. Moss Pdf

This book is primarily intended for graduate chemists and chemical physicists. Indeed, it is based on a graduate course that I give in the Chemistry Depart ment of Southampton University. Nowadays undergraduate chemistry courses usually include an introduction to quantum mechanics with particular reference to molecular properties and there are a number of excellent textbooks aimed specifically at undergraduate chemists. In valence theory and molecular spectroscopy physical concepts are often encountered that are normally taken on trust. For example, electron spin and the anomalous magnetic moment of the electron are usually accepted as postulates, although they are well understood by physicists. In addition, the advent of new techniques has led to experimental situations that can only be accounted for adequately by relatively sophisticated physical theory. Relativis tic corrections to molecular orbital energies are needed to explain X-ray photo electron spectra, while the use oflasers can give rise to multiphoton transitions, which are not easy to understand using the classical theory of radiation. Of course, the relevant equations may be extracted from the literature, but, if the underlying physics is not understood, this is a practice that is at best dissatisfy ing and at worst dangerous. One instance where great care must be taken is in the use of spectroscopically determined parameters to test the accuracy of elec tronic wave functions.

Advanced Molecular Quantum Mechanics

Author : R. E. Moss
Publisher : Unknown
Page : 0 pages
File Size : 47,6 Mb
Release : 1973-06
Category : Quantum chemistry
ISBN : 0470619201

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Advanced Molecular Quantum Mechanics by R. E. Moss Pdf

Advanced Molecular Quantum Mechanics

Author : Richard Edward Moss
Publisher : Unknown
Page : 320 pages
File Size : 42,7 Mb
Release : 1973-05-24
Category : Quantum chemistry
ISBN : 9400956894

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Advanced Molecular Quantum Mechanics by Richard Edward Moss Pdf

Methods of Molecular Quantum Mechanics

Author : Valerio Magnasco
Publisher : John Wiley & Sons
Page : 299 pages
File Size : 46,5 Mb
Release : 2009-10-29
Category : Science
ISBN : 9780470684542

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Methods of Molecular Quantum Mechanics by Valerio Magnasco Pdf

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.

Basic Principles and Techniques of Molecular Quantum Mechanics

Author : Ralph E. Christoffersen
Publisher : Springer Science & Business Media
Page : 698 pages
File Size : 43,6 Mb
Release : 2013-03-08
Category : Science
ISBN : 9781468463606

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Basic Principles and Techniques of Molecular Quantum Mechanics by Ralph E. Christoffersen Pdf

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.

Basic Molecular Quantum Mechanics

Author : Steven A. Adelman
Publisher : CRC Press
Page : 464 pages
File Size : 42,8 Mb
Release : 2021-08-01
Category : Science
ISBN : 9781498734004

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Basic Molecular Quantum Mechanics by Steven A. Adelman Pdf

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.

Quantum Mechanics of Molecular Rate Processes

Author : Raphael D. Levine
Publisher : Courier Corporation
Page : 351 pages
File Size : 43,7 Mb
Release : 2011-11-30
Category : Science
ISBN : 9780486150642

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Quantum Mechanics of Molecular Rate Processes by Raphael D. Levine Pdf

This survey of applications of the theory of collisions and rate processes to molecular problems explores collisions of molecules with internal structure, generalized Ehrenfest theorem, theory of reactive collisions, and role of symmetry. It also reviews partitioning technique, equivalent potentials and quasibound states, theory of direct reactions, more. 1969 edition.

Advanced Quantum Mechanics

Author : RAINER DICK
Publisher : Springer
Page : 692 pages
File Size : 40,8 Mb
Release : 2016-07-01
Category : Science
ISBN : 9783319256757

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Advanced Quantum Mechanics by RAINER DICK Pdf

In this updated and expanded second edition of a well-received and invaluable textbook, Prof. Dick emphasizes the importance of advanced quantum mechanics for materials science and all experimental techniques which employ photon absorption, emission, or scattering. Important aspects of introductory quantum mechanics are covered in the first seven chapters to make the subject self-contained and accessible for a wide audience. Advanced Quantum Mechanics, Materials and Photons can therefore be used for advanced undergraduate courses and introductory graduate courses which are targeted towards students with diverse academic backgrounds from the Natural Sciences or Engineering. To enhance this inclusive aspect of making the subject as accessible as possible Appendices A and B also provide introductions to Lagrangian mechanics and the covariant formulation of electrodynamics. This second edition includes an additional 62 new problems as well as expanded sections on relativistic quantum fields and applications of quantum electrodynamics. Other special features include an introduction to Lagrangian field theory and an integrated discussion of transition amplitudes with discrete or continuous initial or final states. Once students have acquired an understanding of basic quantum mechanics and classical field theory, canonical field quantization is easy. Furthermore, the integrated discussion of transition amplitudes naturally leads to the notions of transition probabilities, decay rates, absorption cross sections and scattering cross sections, which are important for all experimental techniques that use photon probes.

Molecular Quantum Mechanics

Author : Peter W. Atkins,Ronald S. Friedman
Publisher : Oxford University Press
Page : 552 pages
File Size : 43,6 Mb
Release : 2011
Category : Science
ISBN : 9780199541423

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Molecular Quantum Mechanics by Peter W. Atkins,Ronald S. Friedman Pdf

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.

Foundations of Molecular Quantum Electrodynamics

Author : R. Guy Woolley
Publisher : Cambridge University Press
Page : 492 pages
File Size : 49,7 Mb
Release : 2022-09-15
Category : Science
ISBN : 9781009225755

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Foundations of Molecular Quantum Electrodynamics by R. Guy Woolley Pdf

This book presents a comprehensive account of molecular quantum electrodynamics from the perspectives of physics and theoretical chemistry. The first part of the book establishes the essential concepts underlying classical electrodynamics, using the tools of Lagrangian and Hamiltonian mechanics. The second part focuses on the fundamentals of quantum mechanics, particularly how they relate to, and influence, chemical and molecular processes. The special case of the Coulomb Hamiltonian (including the celebrated Born-Oppenheimer approximation) is given a modern treatment. The final part of the book is devoted to non-relativistic quantum electrodynamics and describes in detail its impact upon our understanding of atoms and molecules, and their interaction with light. Particular attention is paid to the Power-Zienau-Woolley (PZW) representations, and both perturbative and non-perturbative approaches to QED calculation are discussed. This book is ideal for graduate students and researchers in chemical and molecular physics, quantum chemistry, and theoretical chemistry.

Methods of Molecular Quantum Mechanics

Author : R. McWeeny,Brian T. Sutcliffe
Publisher : Unknown
Page : 318 pages
File Size : 42,9 Mb
Release : 1969
Category : Science
ISBN : MINN:31951000467159D

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Methods of Molecular Quantum Mechanics by R. McWeeny,Brian T. Sutcliffe Pdf

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)

Advanced Quantum Mechanics

Author : Yuli V. Nazarov,Jeroen Danon
Publisher : Cambridge University Press
Page : 369 pages
File Size : 47,9 Mb
Release : 2013-01-03
Category : Science
ISBN : 9780521761505

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Advanced Quantum Mechanics by Yuli V. Nazarov,Jeroen Danon Pdf

An accessible introduction to advanced quantum theory, this textbook focuses on its practical applications and is ideal for graduate students in physics.

Advances in Quantum Chemistry

Author : Anonim
Publisher : Academic Press
Page : 259 pages
File Size : 51,9 Mb
Release : 2013-07-23
Category : Science
ISBN : 9780124079069

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Advances in Quantum Chemistry by Anonim Pdf

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

Advances in Quantum Chemistry: Lowdin Volume

Author : Anonim
Publisher : Academic Press
Page : 408 pages
File Size : 52,6 Mb
Release : 2017-02-12
Category : Science
ISBN : 9780128104002

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Advances in Quantum Chemistry: Lowdin Volume by Anonim Pdf

Advances in Quantum Chemistry: Lowdin Volume presents a series of articles exploring aspects of the application of quantum mechanics to atoms, molecules, and solids. Celebrates Per-Olov Lowdin, who would have been 100 in 2016 Contains papers by many who use his ideas in theoretical chemistry and physics today

Advances in Quantum Chemistry: Ratner Volume

Author : Anonim
Publisher : Academic Press
Page : 282 pages
File Size : 45,9 Mb
Release : 2017-05-25
Category : Science
ISBN : 9780128128893

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Advances in Quantum Chemistry: Ratner Volume by Anonim Pdf

Advances in Quantum Chemistry, Volume 75 presents work and reviews of current progress in computational quantum mechanics as presented by some of the world’s leading experts. This latest release includes chapters on Mean-Field Methods for Time-Dependent Quantum Dynamics of Many-Atom Systems, Electron–Ion Impact Energy Transfer in Nanoplasmas of Coulomb Exploding Clusters, Molecular Properties of Sandwiched Molecules Between Electrodes and Nanoparticles, Criterion for the Validity of D'Alembert's Equations of Motion, and A Time-Dependent Density Functional Theory Study of the Impact of Ligand Passivation on the Plasmonic Behavior of Ag Nanoclusters. Presents reports on current work in molecular and atomic quantum mechanics Contains work reported by many of the best scientists in the field Dedicated to one of the great practitioners in the field, Mark A. Ratner