Modelling Molecular Structures , 2nd EditionISBN: 978-0-471-48993-1
Paperback
354 pages
October 2000
 This is a Print-on-Demand title. It will be printed specifically to fill your order. Please allow an additional 10-15 days delivery time. The book is not returnable.
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Series Preface
Preface to the First Edition
Preface to the Second Edition
Prerequisites
Molecular Mechanics
Dynamics
The Hydrogen Molecule Ion
The Hydrogen Molecule
The Electron Density
The Hartree-Fock Model
The Hückel Model
Neglect of Differential Overlap Models
Basis Sets
Ab Initio Packages
Electron Correlation
Slater's X Model
Density Functional Therory
Potential Energy Surfaces
Dealing with the Solvent
Primary Properties and their Derivatives
Induced Properties
Miscellany
References
Index
Preface to the First Edition
Preface to the Second Edition
Prerequisites
Molecular Mechanics
Dynamics
The Hydrogen Molecule Ion
The Hydrogen Molecule
The Electron Density
The Hartree-Fock Model
The Hückel Model
Neglect of Differential Overlap Models
Basis Sets
Ab Initio Packages
Electron Correlation
Slater's X Model
Density Functional Therory
Potential Energy Surfaces
Dealing with the Solvent
Primary Properties and their Derivatives
Induced Properties
Miscellany
References
Index
Related Titles
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Computational Chemistry & Molecular Modeling
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