Relativistic Quantum Theory of Atoms and Molecules

Relativistic Quantum Theory of Atoms and Molecules PDF Author: Ian P Grant
Publisher: Springer Science & Business Media
ISBN: 0387350691
Category : Science
Languages : en
Pages : 813

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Book Description
This book is intended for physicists and chemists who need to understand the theory of atomic and molecular structure and processes, and who wish to apply the theory to practical problems. As far as practicable, the book provides a self-contained account of the theory of relativistic atomic and molecular structure, based on the accepted formalism of bound-state Quantum Electrodynamics. The author was elected a Fellow of the Royal Society of London in 1992.

Relativistic Quantum Theory of Atoms and Molecules

Relativistic Quantum Theory of Atoms and Molecules PDF Author: Ian P Grant
Publisher: Springer Science & Business Media
ISBN: 0387350691
Category : Science
Languages : en
Pages : 813

Get Book Here

Book Description
This book is intended for physicists and chemists who need to understand the theory of atomic and molecular structure and processes, and who wish to apply the theory to practical problems. As far as practicable, the book provides a self-contained account of the theory of relativistic atomic and molecular structure, based on the accepted formalism of bound-state Quantum Electrodynamics. The author was elected a Fellow of the Royal Society of London in 1992.

Relativistic Quantum Chemistry

Relativistic Quantum Chemistry PDF Author: Markus Reiher
Publisher: John Wiley & Sons
ISBN: 3527312927
Category : Science
Languages : en
Pages : 780

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Book Description
"Written by two researchers in the field, this book is a reference to explain the principles and fundamentals in a self-contained, complete and consistent way. Much attention is paid to the didactical value, with the chapters interconnected and based on each other. From beginning to end, the authors deduce all the concepts and rules, such that readers are able to understand the fundamentals and principles behind the theory. Essential reading for theoretical chemists and physicists." --Book Jacket.

The Effects of Relativity in Atoms, Molecules, and the Solid State

The Effects of Relativity in Atoms, Molecules, and the Solid State PDF Author: Stephen Wilson
Publisher: Springer Science & Business Media
ISBN: 1461537029
Category : Science
Languages : en
Pages : 341

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Book Description
Recent years have seen a growing interest in the effects of relativity in atoms, molecules and solids. On the one hand, this can be seen as result of the growing awareness of the importance of relativity in describing the properties of heavy atoms and systems containing them. This has been fueled by the inadequacy of physical models which either neglect relativity or which treat it as a small perturbation. On the other hand, it is dependent upon the technological developments which have resulted in computers powerful enough to make calculations on heavy atoms and on systems containing heavy atoms meaningful. Vector processing and, more recently, parallel processing techniques are playing an increasingly vital role in rendering the algorithms which arise in relativistic studies tractable. This has been exemplified in atomic structure theory, where the dominant role of the central nuclear charge simplifies the problem enough to permit some prediction to be made with high precision, especially for the highly ionized atoms of importance in plasma physics and in laser confinement studies. Today's sophisticated physical models of the atom derived from quantum electrodynamics would be intractable without recourse to modern computational machinery. Relativistic atomic structure calculations have a history dating from the early attempts of Swirles in the mid 1930's but continue to provide one of the primary test beds of modern theoretical physics.

Atoms and Molecules

Atoms and Molecules PDF Author: Mitchel Weissbluth
Publisher: Elsevier
ISBN: 032314294X
Category : Science
Languages : en
Pages : 730

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Book Description
Atoms and Molecules describes the basic properties of atoms and molecules in terms of group theoretical methods in atomic and molecular physics. The book reviews mathematical concepts related to angular momentum properties, finite and continuous rotation groups, tensor operators, the Wigner-Eckart theorem, vector fields, and vector spherical harmonics. The text also explains quantum mechanics, including symmetry considerations, second quantization, density matrices, time-dependent, and time-independent approximation methods. The book explains atomic structure, particularly the Dirac equation in which its nonrelativistic approximation provides the basis for the derivation of the Hamiltonians for all important interactions, such as spin-orbit, external fields, hyperfine. Along with multielectron atoms, the text discusses multiplet theory, the Hartree-Fock formulation, as well as the electromagnetic radiation fields, their interactions with atoms in first and higher orders. The book explores molecules and complexes, including the Born-Oppenheimer approximation, molecular orbitals, the self-consistent field method, electronic states, vibrational and rotational states, molecular spectra, and the ligand field theory. The book can prove useful for graduate or advanced students and academicians in the field of general and applied physics.

Relativistic Heavy-Particle Collision Theory

Relativistic Heavy-Particle Collision Theory PDF Author: Derrick S.F. Crothers
Publisher: Springer Science & Business Media
ISBN: 9780306464249
Category : Science
Languages : en
Pages : 328

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Book Description
If a heavy particle ion (atom, molecule, muon) collides with another in the gas phase at speeds approaching the speed of light, the time-dependent Dirac equation equation must be used for its description, including quantum electro-dynamic, special relativity and magnetic coupling effects. In this book we study one electron in the variety of rearrangement collisions: radiative and non-radiative capture, ionization, capture by pair (one electron, one positron) production and antihydrogen production. Our relativistic continuum distorted-wave theory accounts extremely well for the simultaneous behaviour of the electron with respect to the nuclear charges of the projectile and the target. This is the first book developed in this subject. Containing many diagrams and tables, and fully referenced, it goes beyond chapters in previous books. The relativistic continuum distorted-wave theory developed by the authors group, is shown to be fully Hermitean. Detailed mathematics are provided in nine appendices.

The Theory of Photons and Electrons

The Theory of Photons and Electrons PDF Author: Josef M. Jauch
Publisher: Springer Science & Business Media
ISBN: 3642809510
Category : Science
Languages : en
Pages : 569

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Book Description
Since the discovery of the corpuscular nature of radiation by Planck more than fifty years ago the quantum theory of radiation has gone through many stages of development which seemed to alternate between spectacular success and hopeless frustration. The most recent phase started in 1947 with the discovery of the electromagnetic level shifts and the realization that the exist ing theory, when properly interpreted, was perfectly adequate to explain these effects to an apparently unlimited degree of accuracy. This phase has now reached a certain conclusion: for the first time in the checkered history of this field of research it has become possible to give a unified and consistent presen tation of radiation theory in full conformity with the principles of relativity and quantum mechanics. To this task the present book is devoted. The plan for a book of this type was conceived during the year 1951 while the first-named author (J. M. J. ) held a Fulbright research scholarship at Cambridge University. During this year of freedom from teaching and other duties he had the opportunity of conferring with physicists in many different countries on the recent developments in radiation theory. The comments seemed to be almost unanimous that a book on quantum electrodynamics at the present time would be of inestimable value to physicists in many parts of the world. However, it was not until the spring of 1952 that work on the book began in earnest.

Introduction to the Theory of Collisions of Electrons with Atoms and Molecules

Introduction to the Theory of Collisions of Electrons with Atoms and Molecules PDF Author: S.P. Khare
Publisher: Springer Science & Business Media
ISBN: 1461506115
Category : Science
Languages : en
Pages : 362

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Book Description
An understanding of the collisions between micro particles is of great importance for the number of fields belonging to physics, chemistry, astrophysics, biophysics etc. The present book, a theory for electron-atom and molecule collisions is developed using non-relativistic quantum mechanics in a systematic and lucid manner. The scattering theory is an essential part of the quantum mechanics course of all universities. During the last 30 years, the author has lectured on the topics presented in this book (collisions physics, photon-atom collisions, electron-atom and electron-molecule collisions, "electron-photon delayed coincidence technique", etc.) at many institutions including Wayne State University, Detroit, MI, The University of Western Ontario, Canada, and The Meerut University, India. The present book is the outcome of those lectures and is written to serve as a textbook for post-graduate and pre-PhD students and as a reference book for researchers.

Relativistic Electronic Structure Theory - Fundamentals

Relativistic Electronic Structure Theory - Fundamentals PDF Author:
Publisher: Elsevier
ISBN: 0080540465
Category : Science
Languages : en
Pages : 947

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Book Description
The first volume of this two part series is concerned with the fundamental aspects of relativistic quantum theory, outlining the enormous progress made in the last twenty years in this field. The aim was to create a book such that researchers who become interested in this exciting new field find it useful as a textbook, and do not have to rely on a rather large number of specialized papers published in this area.·No title is currently available that deals with new developments in relativistic quantum electronic structure theory·Interesting and relevant to graduate students in chemistry and physics as well as to all researchers in the field of quantum chemistry·As treatment of heavy elements becomes more important, there will be a constant demand for this title

The Quantum Theory of Atoms in Molecules

The Quantum Theory of Atoms in Molecules PDF Author: Chérif F. Matta
Publisher: John Wiley & Sons
ISBN: 3527307486
Category : Science
Languages : en
Pages : 567

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Book Description
This book distills the knowledge gained from research into atoms in molecules over the last 10 years into a unique, handy reference. Throughout, the authors address a wide audience, such that this volume may equally be used as a textbook without compromising its research-oriented character. Clearly structured, the text begins with advances in theory before moving on to theoretical studies of chemical bonding and reactivity. There follow separate sections on solid state and surfaces as well as experimental electron densities, before finishing with applications in biological sciences and drug-design. The result is a must-have for physicochemists, chemists, physicists, spectroscopists and materials scientists.

Quantum Theory for Chemical Applications

Quantum Theory for Chemical Applications PDF Author: Jochen Autschbach
Publisher: Oxford University Press, USA
ISBN: 0190920807
Category : Science
Languages : en
Pages : 756

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Book Description
"Quantum Theory for Chemical Applications (QTCA) Quantum theory, or more specifically, quantum mechanics is endlessly fascinating, curious & strange, and often considered to be difficult to learn. It is true that quantum mechanics is a mathematical theory. Its scope, its predictions, the wisdom we gain from its results, all these become fully clear only in the context of the relevant equations and calculations. But the study of quantum mechanics is definitely worth the effort, and - as I like to tell my students- it is not rocket science"--