Symmetry of Many-Electron Systems PDF Download

Author: I. G. Kaplan
Publisher: Academic Press
ISBN: 1483191737
Category : Science
Languages : en
Pages : 385

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Book Description
Symmetry of Many-Electron Systems discusses the group-theoretical methods applied to physical and chemical problems. Group theory allows an individual to analyze qualitatively the elements of a certain system in scope. The text evaluates the characteristics of the Schrodinger equations. It is proved that some groups of continuous transformation from the Lie groups are useful in identifying conditions and in developing wavefunctions. A section of the book is devoted to the utilization of group-theoretical methods in quantal calculations on many-electron systems. The focus is on the use of group-theoretical methods to the classification and calculation of states of molecule. A chapter of the book gives a comprehensive discussion of the fractional parentage method. This application is used in atomic and nuclear spectroscopy. The method of employing coordinate wave functions is explained. The standard Young-Yamanouchi orthogonal representation is presented completely. The book will provide useful guides for physicists, chemists, engineers, students, and researchers in the field of physics.

Author: Ajit Thakkar
Publisher: Morgan & Claypool Publishers
ISBN: 1681746387
Category : Science
Languages : en
Pages : 134

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Book Description
This book provides non-specialists with a basic understanding ofthe underlying concepts of quantum chemistry. It is both a text for second or third-year undergraduates and a reference for researchers who need a quick introduction or refresher. All chemists and many biochemists, materials scientists, engineers, and physicists routinely user spectroscopic measurements and electronic structure computations in their work. The emphasis of Quantum Chemistry on explaining ideas rather than enumerating facts or presenting procedural details makes this an excellent foundation text/reference. The keystone is laid in the first two chapters which deal with molecular symmetry and the postulates of quantum mechanics, respectively. Symmetry is woven through the narrative of the next three chapters dealing with simple models of translational, rotational, and vibrational motion that underlie molecular spectroscopy and statistical thermodynamics. The next two chapters deal with the electronic structure of the hydrogen atom and hydrogen molecule ion, respectively. Having been armed with a basic knowledge of these prototypical systems, the reader is ready to learn, in the next chapter, the fundamental ideas used to deal with the complexities of many-electron atoms and molecules. These somewhat abstract ideas are illustrated with the venerable Huckel model of planar hydrocarbons in the penultimate chapter. The book concludes with an explanation of the bare minimum of technical choices that must be made to do meaningful electronic structure computations using quantum chemistry software packages.

Author: V.P. Gupta
Publisher: Academic Press
ISBN: 0128035013
Category : Science
Languages : en
Pages : 480

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Book Description
Principles and Applications of Quantum Chemistry offers clear and simple coverage based on the author's extensive teaching at advanced universities around the globe. Where needed, derivations are detailed in an easy-to-follow manner so that you will understand the physical and mathematical aspects of quantum chemistry and molecular electronic structure. Building on this foundation, this book then explores applications, using illustrative examples to demonstrate the use of quantum chemical tools in research problems. Each chapter also uses innovative problems and bibliographic references to guide you, and throughout the book chapters cover important advances in the field including: Density functional theory (DFT) and time-dependent DFT (TD-DFT), characterization of chemical reactions, prediction of molecular geometry, molecular electrostatic potential, and quantum theory of atoms in molecules. - Simplified mathematical content and derivations for reader understanding - Useful overview of advances in the field such as Density Functional Theory (DFT) and Time-Dependent DFT (TD-DFT) - Accessible level for students and researchers interested in the use of quantum chemistry tools

Author: D.J. Thouless
Publisher: Courier Corporation
ISBN: 0486493571
Category : Science
Languages : en
Pages : 258

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Book Description
"Unabridged republication of the second edition of the work, originally published in the Pure and applied physics series by Academic Press, Inc., New York, in 1972"--Title page verso.

Author: Hal Tasaki
Publisher: Springer Nature
ISBN: 3030412652
Category : Technology & Engineering
Languages : en
Pages : 534

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Book Description
This book is a self-contained advanced textbook on the mathematical-physical aspects of quantum many-body systems, which begins with a pedagogical presentation of the necessary background information before moving on to subjects of active research, including topological phases of matter. The book explores in detail selected topics in quantum spin systems and lattice electron systems, namely, long-range order and spontaneous symmetry breaking in the antiferromagnetic Heisenberg model in two or higher dimensions (Part I), Haldane phenomena in antiferromagnetic quantum spin chains and related topics in topological phases of quantum matter (Part II), and the origin of magnetism in various versions of the Hubbard model (Part III). Each of these topics represents certain nontrivial phenomena or features that are invariably encountered in a variety of quantum many-body systems, including quantum field theory, condensed matter systems, cold atoms, and artificial quantum systems designed for future quantum computers. The book’s main focus is on universal properties of quantum many-body systems. The book includes roughly 50 problems with detailed solutions. The reader only requires elementary linear algebra and calculus to comprehend the material and work through the problems. Given its scope and format, the book is suitable both for self-study and as a textbook for graduate or advanced undergraduate classes.

Author: Giuseppe-Franco Bassani
Publisher: Springer Science & Business Media
ISBN: 3540480951
Category : Science
Languages : it
Pages : 311

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Book Description
A century after his birth, Ettore Majorana is rightfully considered one of the greatest physicists of the first half of the last century. With this volume the Italian Physical Society presents a collection of Ettore Majorana's scientific papers in the original language and, for the first time -- with three exceptions -- translated into English. Each paper is then followed by a comment in English of an expert in the scientific field.

Author: A Kitaigorodsky
Publisher: Elsevier
ISBN: 0323145655
Category : Science
Languages : en
Pages : 571

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Book Description
Molecular Crystals and Molecules deals with some of the problems of molecular crystallography and certain aspects of molecular structure. This book is composed of eight chapters that specifically cover the significant progress of conformational research. The opening chapter describes the structure of crystals considering the close-packing principle, disorder elements, and binary systems. The next two chapters examine the calculation of crystal lattice energy and dynamics. These topics are followed by discussions on the molecular movement, structural, and thermodynamic aspects of crystals. The final chapters look into the parameters for conformational calculations of molecules, macromolecules, and biopolymers. This book will be of great value to physical chemists and researchers who are interested in crystal and molecular structure.

Author: Ilya G. Kaplan
Publisher: John Wiley & Sons
ISBN: 1118795296
Category : Science
Languages : en
Pages : 254

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Book Description
This is the first scientic book devoted to the Pauli exclusion principle, which is a fundamental principle of quantum mechanics and is permanently applied in chemistry, physics, and molecular biology. However, while the principle has been studied for more than 90 years, rigorous theoretical foundations still have not been established and many unsolved problems remain. Following a historical survey in Chapter 1, the book discusses the still unresolved questions around this fundamental principle. For instance, why, according to the Pauli exclusion principle, are only symmetric and antisymmetric permutation symmetries for identical particles realized, while the Schrödinger equation is satisfied by functions with any permutation symmetry? Chapter 3 covers possible answers to this question. The construction of function with a given permutation symmetry is described in the previous Chapter 2, while Chapter 4 presents effective and elegant methods for finding the Pauli-allowed states in atomic, molecular, and nuclear spectroscopy. Chapter 5 discusses parastatistics and fractional statistics, demonstrating that the quasiparticles in a periodical lattice, including excitons and magnons, are obeying modified parafermi statistics. With detailed appendices, The Pauli Exclusion Principle: Origin, Verifications, and Applications is intended as a self-sufficient guide for graduate students and academic researchers in the fields of chemistry, physics, molecular biology and applied mathematics. It will be a valuable resource for any reader interested in the foundations of quantum mechanics and its applications, including areas such as atomic and molecular spectroscopy, spintronics, theoretical chemistry, and applied fields of quantum information.

Author: Daniel C. Harris
Publisher: Courier Corporation
ISBN: 9780486661445
Category : Science
Languages : en
Pages : 588

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Book Description
Informal, effective undergraduate-level text introduces vibrational and electronic spectroscopy, presenting applications of group theory to the interpretation of UV, visible, and infrared spectra without assuming a high level of background knowledge. 200 problems with solutions. Numerous illustrations. "A uniform and consistent treatment of the subject matter." — Journal of Chemical Education.

Author: Satoru Sugano
Publisher: Elsevier
ISBN: 0323154794
Category : Science
Languages : en
Pages : 348

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Book Description
Multiplets of Transition-Metal Ions in Crystals provides information pertinent to ligand field theory. This book discusses the fundamentals of quantum mechanics and the theory of atomic spectra. Comprised of 10 chapters, this book starts with an overview of the qualitative nature of the splitting of the energy level as well as the angular behavior of the wavefunctions. This text then examines the problem of obtaining the energy eigenvalues and eigenstates of the two-electron systems, in which two electrons are accommodated in the t2g and eg shells in a variety of ways. Other chapters discuss the ligand-field potential, which is invariant to any symmetry operation in the group to which symmetry of the system belongs. This book discusses as well the approximate method of expressing molecular orbitals (MO) by a suitable linear combination of atomic orbitals (AO). The final chapter discusses the MO in molecules and the self-consistent field theory of Hartree–Fock. This book is a valuable resource for research physicists, chemists, electronic engineers, and graduate students.