Author: Michael A. MorrisonPublisher: Prentice Hall
ISBN:
Category : Science
Languages : en
Pages : 600
Book Description
Problems after each chapter
Quantum States of Atoms, Molecules, and Solids
Author: Michael A. MorrisonPublisher: Prentice Hall
ISBN:
Category : Science
Languages : en
Pages : 600
Book Description
Problems after each chapter
The Quantum Theory of Atoms in Molecules
Author: Chérif F. MattaPublisher: John Wiley & Sons
ISBN: 3527307486
Category : Science
Languages : en
Pages : 567
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.
Understanding Properties of Atoms, Molecules and Materials
Author: Pranab SarkarPublisher: CRC Press
ISBN: 1000504433
Category : Science
Languages : en
Pages : 433
Book Description
In a technology driven civilization the quest for new and smarter materials is everlasting. They are required as platforms for developing new technologies or for improving an already existing technology. The discovery of a new material is no longer chance driven or accidental, but is based on careful reasoning structured by deep understanding of the microconstituents of materials - the atoms and molecules in isolation or in an assembly. That requires fair amount of exposure to quantum and statistical mechanics. `Understanding Properties of Atoms, Molecules and Materials' is an effort (perhaps the first ever) to bring all the necessary theoretical ingredients and relevant physical information in a single volume. The book introduces the readers (first year graduates) or researchers in material chemistry/engineering to elementary quantum mechanics of atoms, molecules and solids and then goes on to make them acquainted with methods of statistical mechanics (classical as well as quantum) along with elementary principles of classical MD simulation. The basic concepts are introduced with clarity and illustrated with easy to grasp examples, thus preparing the readers for an exploration through the world of materials - the exotic and the mundane. The emphasis has been on the phenomena and what shapes them at the fundamental level. A comprehensive description of modern designing principles for materials with examples is a unique feature of the book. The highlights of the book are comprehensive introduction and analysis of Quantum states of atoms and molecules The translational symmetry and quantum states in periodic and amorphous solids Band structure and tuning Classical and quantum statistics with applications to ideal gases (photons, phonons and electrons, molecules) Quantum states in type-I and type-II superconductors (elementary theory included) Magnetic materials, materials with GMR and CMR Shape memory effects in alloys and materials 2D materials (graphene and graphene analogus) NLO and photovoltaic materials Hydrogen storage material for mitigating the looming energy crisis Quantum states in low and high band gap semiconductors Semimetals Designer materials, etc. The volume is designed and organized to create interest in the science of materials and the silent revolution that is redefining the goals and boundaries of materials science continuously.
The Effects of Relativity in Atoms, Molecules, and the Solid State
Author: Stephen WilsonPublisher: Springer Science & Business Media
ISBN: 1461537029
Category : Science
Languages : en
Pages : 341
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.
Excited States in Quantum Chemistry
Author: Cleanthes A. NicolaidesPublisher: Springer Science & Business Media
ISBN: 940099902X
Category : Science
Languages : en
Pages : 572
Book Description
It is undoubtedly true that much of the progress in the quant~m theory of matter is due to the remarkable success of the independent particle model (IPM)--especially in describing ground states. However, the accurate experimental results of the last 10 years or so, on a variety of spectroscopic phenomena and chemical processes which involve the Excited State, and the related failure of the IPM to reproduce accurately--in many cases, even qualitatively--the observed data, have sent to theorists a clear message: There is need to create and/or apply general and useful approaches to the many-electron problem of the excited state which go beyond the IPM, treat electron correlation and relativity and explain or predict all relevant physical or chemical information with consistent accuracy. This book contains articles devoted mainly to some of the most important new developments in Quantum Chemistry concerning the theoretical foundations and the computational implementation of many-body approaches to the quantitative and detailed under standing of the electronic excited states of atoms, molecules and solids. Furthermore, it contains experimental and pheno menological articles on Photoelectron and Auger spectroscopy, Lifetime measurements and Organic Photochemistry. In combination or individually, these articles constitute a good description of some current theoretical and experimental work on the electronic structure and spectroscopy of atoms, molecules, polymers, surfaces, metal oxides and amorphous solids.
Atoms in Molecules
Author: Richard F. W. BaderPublisher: Oxford University Press on Demand
ISBN: 9780198558651
Category : Science
Languages : en
Pages : 438
Book Description
The molecular structure hypothesis - that a molecule is a collection of atoms linked by a network of bonds - was forged in the crucible of nineteenth century experimental chemistry and has continued to serve as the principal means of ordering and classifying the observations of chemistry. There is a difficulty with the hypothesis, however, in that it is not related directly to the physics which governs the motions of the nuclei and electrons that make up the atoms and the bonds. It isthe purpose of this important book - now available in paperback for the first time - to show that a theory can be developed to underpin the molecular structure hypothesis - that the atoms in a molecule are real, with properties predicted and defined by the laws of quantum mechanics can be incorporated into the resulting theory - a theory of atoms in molecules. The book is aimed at those scientists responsible for performing the experiments and collecting the observations on the properties ofmatter at the atomic level, in the belief that the transformation of qualitative concepts into a qualitative theory will serve to deepen our understanding of chemistry.
Quantum Phase Transitions in Cold Atoms and Low Temperature Solids
Author: Kaden Richard Alan HazzardPublisher: Springer Science & Business Media
ISBN: 1441981799
Category : Science
Languages : en
Pages : 239
Book Description
The primary focus of this thesis is to theoretically describe nanokelvin experiments in cold atomic gases, which offer the potential to revolutionize our understanding of strongly correlated many-body systems. The thesis attacks major challenges of the field: it proposes and analyzes experimental protocols to create new and interesting states of matter and introduces theoretical techniques to describe probes of these states. The phenomena considered include the fractional quantum Hall effect, spectroscopy of strongly correlated states, and quantum criticality, among others. The thesis also clarifies experiments on disordered quantum solids, which display a variety of exotic phenomena and are candidates to exhibit so-called "supersolidity." It collects experimental results and constrains their interpretation through theoretical considerations. This Doctoral Thesis has been accepted by Cornell University, Ithaca, USA.
Relativistic Quantum Theory of Atoms and Molecules
Author: Ian P GrantPublisher: Springer Science & Business Media
ISBN: 0387350691
Category : Science
Languages : en
Pages : 813
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.
Applications of Group Theory to Atoms, Molecules, and Solids
Author: Thomas WolframPublisher: Cambridge University Press
ISBN: 1107028523
Category : Mathematics
Languages : en
Pages : 485
Book Description
An applications-oriented approach gives graduate students and researchers in the physical sciences the tools needed to analyze any physical system.
Electron Correlations in Molecules and Solids
Author: Peter FuldePublisher: Springer Science & Business Media
ISBN: 3642578098
Category : Science
Languages : en
Pages : 492
Book Description
Dieser Titel verbindet die Festkörpertheorie mit der Quantenchemie. Neue Konzepte der Vielteilchen-Verarbeitung und Korrelations-Effekte, normale quantenchemische Verfahren mit Projektionstechniken, Greensche Funktionen und Monte-Carlo-Methoden werden erarbeitet. Anwendungsbereiche der Molekültheorie, von Halbleitern, supraleitender high-Tc-Materialien, etc., werden vorgestellt.