Fundamentals of Quantum Chemistry

Fundamentals of Quantum Chemistry PDF Author: J. E. House
Publisher: Academic Press
ISBN: 0123567718
Category : Science
Languages : en
Pages : 310

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Book Description
This is a self-contained student-friendly introduction to the key concepts of quantum chemistry. The math is developed as needed and motivated by the concepts themselves. (Midwest).

Fundamentals of Quantum Chemistry

Fundamentals of Quantum Chemistry PDF Author: J. E. House
Publisher: Academic Press
ISBN: 0123567718
Category : Science
Languages : en
Pages : 310

Get Book Here

Book Description
This is a self-contained student-friendly introduction to the key concepts of quantum chemistry. The math is developed as needed and motivated by the concepts themselves. (Midwest).

Fundamentals of Quantum Chemistry

Fundamentals of Quantum Chemistry PDF Author: Michael R. Mueller
Publisher: Springer Science & Business Media
ISBN: 0306465965
Category : Science
Languages : en
Pages : 277

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Book Description
This textbook for undergraduate chemistry majors introduces the principles and formulations of quantum mechanics in chemistry, and their application to vibrational and rotational spectroscopy of diatomic and polyatomic molecules. The last chapter presents three methods for performing electronic structure computations of molecules: ab initio, semi-empirical, and density functional. c. Book News Inc.

Fundamentals of Quantum Mechanics

Fundamentals of Quantum Mechanics PDF Author: James E. House
Publisher: Academic Press
ISBN: 0128092556
Category : Science
Languages : en
Pages : 374

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Book Description
Fundamentals of Quantum Mechanics, Third Edition is a clear and detailed introduction to quantum mechanics and its applications in chemistry and physics. All required math is clearly explained, including intermediate steps in derivations, and concise review of the math is included in the text at appropriate points. Most of the elementary quantum mechanical models—including particles in boxes, rigid rotor, harmonic oscillator, barrier penetration, hydrogen atom—are clearly and completely presented. Applications of these models to selected "real world topics are also included.This new edition includes many new topics such as band theory and heat capacity of solids, spectroscopy of molecules and complexes (including applications to ligand field theory), and small molecules of astrophysical interest. - Accessible style and colorful illustrations make the content appropriate for professional researchers and students alike - Presents results of quantum mechanical calculations that can be performed with readily available software - Provides exceptionally clear discussions of spin-orbit coupling and group theory, and comprehensive coverage of barrier penetration (quantum mechanical tunneling) that touches upon hot topics, such as superconductivity and scanning tunneling microscopy - Problems given at the end of each chapter help students to master concepts

Principles and Applications of Quantum Chemistry

Principles and Applications of Quantum Chemistry PDF 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

Introduction to Quantum Mechanics with Applications to Chemistry

Introduction to Quantum Mechanics with Applications to Chemistry PDF Author: Linus Pauling
Publisher: Courier Corporation
ISBN: 0486134938
Category : Science
Languages : en
Pages : 500

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Book Description
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.

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.

Essentials of Computational Chemistry

Essentials of Computational Chemistry PDF Author: Christopher J. Cramer
Publisher: John Wiley & Sons
ISBN: 1118712277
Category : Science
Languages : en
Pages : 624

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Book Description
Essentials of Computational Chemistry provides a balanced introduction to this dynamic subject. Suitable for both experimentalists and theorists, a wide range of samples and applications are included drawn from all key areas. The book carefully leads the reader thorough the necessary equations providing information explanations and reasoning where necessary and firmly placing each equation in context.

Modern Quantum Chemistry

Modern Quantum Chemistry PDF Author: Attila Szabo
Publisher: Courier Corporation
ISBN: 0486134598
Category : Science
Languages : en
Pages : 484

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Book Description
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.

Fundamentals of Quantum Optics

Fundamentals of Quantum Optics PDF Author: John R. Klauder
Publisher: Courier Corporation
ISBN: 0486450082
Category : Science
Languages : en
Pages : 306

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Book Description
This graduate-level text surveys the fundamentals of quantum optics, including the quantum theory of partial coherence and the nature of the relations between classical and quantum theories of coherence.1968 edition.

Quantum Mechanics with Applications to Nanotechnology and Information Science

Quantum Mechanics with Applications to Nanotechnology and Information Science PDF Author: Yehuda B. Band
Publisher: Academic Press
ISBN: 0444537872
Category : Science
Languages : en
Pages : 993

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Book Description
Quantum mechanics transcends and supplants classical mechanics at the atomic and subatomic levels. It provides the underlying framework for many subfields of physics, chemistry and materials science, including condensed matter physics, atomic physics, molecular physics, quantum chemistry, particle physics, and nuclear physics. It is the only way we can understand the structure of materials, from the semiconductors in our computers to the metal in our automobiles. It is also the scaffolding supporting much of nanoscience and nanotechnology. The purpose of this book is to present the fundamentals of quantum theory within a modern perspective, with emphasis on applications to nanoscience and nanotechnology, and information-technology. As the frontiers of science have advanced, the sort of curriculum adequate for students in the sciences and engineering twenty years ago is no longer satisfactory today. Hence, the emphasis on new topics that are not included in older reference texts, such as quantum information theory, decoherence and dissipation, and on applications to nanotechnology, including quantum dots, wires and wells. - This book provides a novel approach to Quantum Mechanics whilst also giving readers the requisite background and training for the scientists and engineers of the 21st Century who need to come to grips with quantum phenomena - The fundamentals of quantum theory are provided within a modern perspective, with emphasis on applications to nanoscience and nanotechnology, and information-technology - Older books on quantum mechanics do not contain the amalgam of ideas, concepts and tools necessary to prepare engineers and scientists to deal with the new facets of quantum mechanics and their application to quantum information science and nanotechnology - As the frontiers of science have advanced, the sort of curriculum adequate for students in the sciences and engineering twenty years ago is no longer satisfactory today - There are many excellent quantum mechanics books available, but none have the emphasis on nanotechnology and quantum information science that this book has