Elementary Molecular Quantum Mechanics

The second edition of Elementary Molecular Quantum Mechanics shows the methods of molecular quantum mechanics for graduate University students of Chemistry and Physics. This readable book teaches in detail the mathematical methods needed to do working applications in molecular quantum mechanics, as a preliminary step before using commercial programmes doing quantum chemistry calculations. This book aims to bridge the gap between the classic Coulson’s Valence, where application of wave mechanical principles to valence theory is presented in a fully non-mathematical way, and McWeeny’s Methods of Molecular Quantum Mechanics, where recent advances in the application of quantum mechanical methods to molecular problems are presented at a research level in a full mathematical way. Many examples and mathematical points are given as problems at the end of each chapter, with a hint for their solution. Solutions are then worked out in detail in the last section of each Chapter. Uses clear and simplified examples to demonstrate the methods of molecular quantum mechanics Simplifies all mathematical formulae for the reader Provides educational training in basic methodology

Produk Detail:

  • Author : Valerio Magnasco
  • Publisher : Elsevier
  • Pages : 1012 pages
  • ISBN : 0444626662
  • Rating : 4/5 from 21 reviews
CLICK HERE TO GET THIS BOOKElementary Molecular Quantum Mechanics

Elementary Molecular Quantum Mechanics

Elementary Molecular Quantum Mechanics
  • Author : Valerio Magnasco
  • Publisher : Elsevier
  • Release : 07 August 2013
GET THIS BOOKElementary Molecular Quantum Mechanics

The second edition of Elementary Molecular Quantum Mechanics shows the methods of molecular quantum mechanics for graduate University students of Chemistry and Physics. This readable book teaches in detail the mathematical methods needed to do working applications in molecular quantum mechanics, as a preliminary step before using commercial programmes doing quantum chemistry calculations. This book aims to bridge the gap between the classic Coulson’s Valence, where application of wave mechanical principles to valence theory is presented in a fully

Elementary Methods of Molecular Quantum Mechanics

Elementary Methods of Molecular Quantum Mechanics
  • Author : Valerio Magnasco
  • Publisher : Elsevier
  • Release : 20 December 2006
GET THIS BOOKElementary Methods of Molecular Quantum Mechanics

Elementary Methods of Molecular Quantum Mechanics shows the methods of molecular quantum mechanics for graduate University students of Chemistry and Physics. This readable book teaches in detail the mathematical methods needed to do working applications in molecular quantum mechanics, as a preliminary step before using commercial programmes doing quantum chemistry calculations. This book aims to bridge the gap between the classic Coulson’s Valence, where application of wave mechanical principles to valence theory is presented in a fully non-mathematical way,

Methods of Molecular Quantum Mechanics

Methods of Molecular Quantum Mechanics
  • Author : Valerio Magnasco
  • Publisher : John Wiley & Sons
  • Release : 12 January 2010
GET THIS BOOKMethods of Molecular Quantum Mechanics

This advanced text introduces to the advanced undergraduate and graduate student the mathematical foundations of the methods needed to carry out practical applications in electronic molecular quantum mechanics, a necessary preliminary step before using commercial programmes to carry out quantum chemistry calculations. Major features of the book include: Consistent use of the system of atomic units, essential for simplifying all mathematical formulae Introductory use of density matrix techniques for interpreting properties of many-body systems An introduction to valence bond methods

Methods of Molecular Quantum Mechanics

Methods of Molecular Quantum Mechanics
  • Author : Valerio Magnasco
  • Publisher : John Wiley & Sons
  • Release : 29 October 2009
GET THIS BOOKMethods of Molecular Quantum Mechanics

This advanced text introduces to the advanced undergraduate and graduate student the mathematical foundations of the methods needed to carry out practical applications in electronic molecular quantum mechanics, a necessary preliminary step before using commercial programmes to carry out quantum chemistry calculations. Major features of the book include: Consistent use of the system of atomic units, essential for simplifying all mathematical formulae Introductory use of density matrix techniques for interpreting properties of many-body systems An introduction to valence bond methods

Basic Molecular Quantum Mechanics

Basic Molecular Quantum Mechanics
  • Author : Steven A. Adelman
  • Publisher : CRC Press
  • Release : 01 August 2021
GET THIS BOOKBasic Molecular Quantum Mechanics

Quantum mechanics is a general theory of the motions, structures, properties, and behaviors of particles of atomic and subatomic dimensions. While quantum mechanics was created in the first third of the twentieth century by a handful of theoretical physicists working on a limited number of problems, it has further developed and is now applied by a great number of people working on a vast range of problems in wide areas of science and technology. Basic Molecular Quantum Mechanics introduces quantum

Ideas of Quantum Chemistry

Ideas of Quantum Chemistry
  • Author : Lucjan Piela
  • Publisher : Elsevier
  • Release : 28 November 2006
GET THIS BOOKIdeas of Quantum Chemistry

Ideas of Quantum Chemistry shows how quantum mechanics is applied to chemistry to give it a theoretical foundation. The structure of the book (a TREE-form) emphasizes the logical relationships between various topics, facts and methods. It shows the reader which parts of the text are needed for understanding specific aspects of the subject matter. Interspersed throughout the text are short biographies of key scientists and their contributions to the development of the field. Ideas of Quantum Chemistry has both textbook

Quantum Chemistry

Quantum Chemistry
  • Author : Tomofumi Tada
  • Publisher : BoD – Books on Demand
  • Release : 21 March 2012
GET THIS BOOKQuantum Chemistry

Molecules, small structures composed of atoms, are essential substances for lives. However, we didn't have the clear answer to the following questions until the 1920s: why molecules can exist in stable as rigid networks between atoms, and why molecules can change into different types of molecules. The most important event for solving the puzzles is the discovery of the quantum mechanics. Quantum mechanics is the theory for small particles such as electrons and nuclei, and was applied to hydrogen molecule

Elementary Quantum Chemistry

Elementary Quantum Chemistry
  • Author : Frank L. Pilar
  • Publisher : Courier Corporation
  • Release : 01 January 2001
GET THIS BOOKElementary Quantum Chemistry

Useful introductory course and reference covers origins of quantum theory, Schrödinger wave equation, quantum mechanics of simple systems, electron spin, quantum states of atoms, Hartree-Fock self-consistent field method, more. 1990 edition.

Quantum Mechanics For Organic Chemists

Quantum Mechanics For Organic Chemists
  • Author : Howard Zimmerman
  • Publisher : Elsevier
  • Release : 02 December 2012
GET THIS BOOKQuantum Mechanics For Organic Chemists

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

Multiscale Modeling in Nanophotonics

Multiscale Modeling in Nanophotonics
  • Author : Alexander Bagaturyants,Mikhail Vener
  • Publisher : CRC Press
  • Release : 22 November 2017
GET THIS BOOKMultiscale Modeling in Nanophotonics

The idea of theoretically predicting the useful properties of various materials using multiscale simulations has become popular in recent years. Of special interest are nanostructured, organic functional materials, which have a hierarchical structure and are considered materials of the future because of their flexibility and versatility. Their functional properties are inherited from the molecule that lies at the heart of the hierarchical structure. On the other hand, the properties of this functional molecule, in particular its absorption and emission spectra,

Introduction to Elementary Molecular Orbital Theory and to Semiempirical Methods

Introduction to Elementary Molecular Orbital Theory and to Semiempirical Methods
  • Author : G.H. Wagniere
  • Publisher : Springer Science & Business Media
  • Release : 06 December 2012
GET THIS BOOKIntroduction to Elementary Molecular Orbital Theory and to Semiempirical Methods

These notes summarize in part lectures held regularly at the University of Zurich and, in the Summer of 1974, at the Semi nario Latinoamericano de QUimica Cuantica in Mexico. I am grateful to those who have encouraged me to publish these lec tures or have contributed to them by their suggestions. In particular, I wish to thank Professor J. Keller of the Univer sidad Nacional Autonoma in Mexico, Professor H. Labhart and Professor H. Fischer of the University of Zurich, as

Intermolecular Interactions in Crystals

Intermolecular Interactions in Crystals
  • Author : Juan J Novoa
  • Publisher : Royal Society of Chemistry
  • Release : 25 October 2017
GET THIS BOOKIntermolecular Interactions in Crystals

The field of crystal engineering concerns the design and synthesis of molecular crystals with desired properties. This requires an in-depth understanding of the intermolecular interactions within crystal structures. This new book brings together the latest information and theories about intermolecular bonding, providing an introductory text for graduates. The book is divided into three parts. The first part covers the nature, physical meaning and methods for identification and analysis of intermolecular bonds. The second part explains the different types of bond

Fundamentals of Quantum Mechanics

Fundamentals of Quantum Mechanics
  • Author : J. E. House
  • Publisher : Academic Press
  • Release : 19 April 2017
GET THIS BOOKFundamentals of Quantum Mechanics

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