Author : David O. Hayward
Publisher : Royal Society of Chemistry
Page : 196 pages
File Size : 39,63 MB
Release : 2002
Category : Education
ISBN : 9780854046072
This book is designed to provide chemistry undergraduates with a basic understanding of the principles of quantum mechanics.
Author : George C. Schatz
Publisher : Courier Corporation
Page : 386 pages
File Size : 49,44 MB
Release : 2012-04-30
Category : Science
ISBN : 0486136728
Advanced graduate-level text looks at symmetry, rotations, and angular momentum addition; occupation number representations; and scattering theory. Uses concepts to develop basic theories of chemical reaction rates. Problems and answers.
Author : Linus Pauling
Publisher : Courier Corporation
Page : 500 pages
File Size : 19,12 MB
Release : 2012-06-08
Category : Science
ISBN : 0486134938
Classic undergraduate text explores wave functions for the hydrogen atom, perturbation theory, the Pauli exclusion principle, and the structure of simple and complex molecules. Numerous tables and figures.
Author : Donald D. Fitts
Publisher : Cambridge University Press
Page : 366 pages
File Size : 25,76 MB
Release : 1999-08-26
Category : Science
ISBN : 0521651247
This text presents a rigorous mathematical account of the principles of quantum mechanics, in particular as applied to chemistry and chemical physics. Applications are used as illustrations of the basic theory. The first two chapters serve as an introduction to quantum theory, although it is assumed that the reader has been exposed to elementary quantum mechanics as part of an undergraduate physical chemistry or atomic physics course. Following a discussion of wave motion leading to Schrödinger's wave mechanics, the postulates of quantum mechanics are presented along with essential mathematical concepts and techniques. The postulates are rigorously applied to the harmonic oscillator, angular momentum, the hydrogen atom, the variation method, perturbation theory, and nuclear motion. Modern theoretical concepts such as hermitian operators, Hilbert space, Dirac notation, and ladder operators are introduced and used throughout. This text is appropriate for beginning graduate students in chemistry, chemical physics, molecular physics and materials science.
Author : Jack Simons
Publisher : Oxford University Press on Demand
Page : 612 pages
File Size : 10,82 MB
Release : 1997
Category : History
ISBN : 9780195082005
Written for beginning graduate students and advanced undergraduates in all areas of chemistry, this text offers great flexibility. It is unique in that it combines both introductory and modern quantum chemistry in a single book. The introductory material is covered in less detail, allowing the instructor to extend the coverage into areas of greater importance, including introductions to molecular spectroscopy and chemical dynamics and a very thorough group of chapters on computational chemistry as applied to electronic structures. A large number of exercises, problems, and solutions, and a disk of text-related computer programs are also included, further enhancing the utility value of the text.
Author : Attila Szabo
Publisher : Courier Corporation
Page : 484 pages
File Size : 36,67 MB
Release : 2012-06-08
Category : Science
ISBN : 0486134598
This graduate-level text explains the modern in-depth approaches to the calculation of electronic structure and the properties of molecules. Largely self-contained, it features more than 150 exercises. 1989 edition.
Author : Markus Reiher
Publisher : John Wiley & Sons
Page : 692 pages
File Size : 32,83 MB
Release : 2009-05-13
Category : Science
ISBN : 3527627499
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 the contents: * Fundamentals * Relativistic Theory of a Free Electron: Diracï¿1⁄2s Equation * Dirac Theory of a Single Electron in a Central Potential * Many-Electron Theory I: Quantum Electrodynamics * Many-Electron Theory II: Dirac-Hartree-Fock Theory * Elimination of the Small Component * Unitary Transformation Schemes * Relativistic Density Functional Theory * Physical Observables and Molecular Properties * Interpretive Approach to Relativistic Quantum Chemistry 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.
Author : Mark A. Ratner
Publisher : Pearson
Page : 328 pages
File Size : 40,90 MB
Release : 2001
Category : Science
ISBN :
This book serves as a self-study guide to familiarize users with the crucial language of modern chemistry science. It provides a background of electronic structure programs, and includes worked examples in problem solving and computer exercises. For computational chemists, materials scientists, and chemical engineers who want to learn more about their field without unnecessary complexity, detail, or formalism.
Author : Howard Zimmerman
Publisher : Academic Press
Page : 234 pages
File Size : 14,50 MB
Release : 1975-05-28
Category : Science
ISBN :
Quantum Mechanics for Organic Chemists is based on the author's first-year graduate course on quantum mechanics for Organic Chemistry majors. The book not only makes a gradual transition from elementary to advanced, but also tries an approach that allows students to have a more intuitive learning. The book covers concepts in quantum physics and topics such as the LCAO-MO Huckel Approach; group theory; and extensions, modifications, and applications of the Huckel approach. Also included in the book are the areas of three-dimensional treatments; polyelectron wave functions; the Slater determinant; and Pople's SCF equations. The text is recommended for graduate students of organic chemistry who would like to know more about the applications of quantum mechanics in their field. Quantum physicists who are interested in the field of organic chemistry would also find the book appealing.
Author : Stefanos Trachanas
Publisher : John Wiley & Sons
Page : 564 pages
File Size : 33,69 MB
Release : 2018-02-20
Category : Science
ISBN : 3527412476
This modern textbook offers an introduction to Quantum Mechanics as a theory that underlies the world around us, from atoms and molecules to materials, lasers, and other applications. The main features of the book are: Emphasis on the key principles with minimal mathematical formalism Demystifying discussions of the basic features of quantum systems, using dimensional analysis and order-of-magnitude estimates to develop intuition Comprehensive overview of the key concepts of quantum chemistry and the electronic structure of solids Extensive discussion of the basic processes and applications of light-matter interactions Online supplement with advanced theory, multiple-choice quizzes, etc.
