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A chemist's guide to valence bond theory /
This is the first book to discuss modern valence bond theory in a pedagogical context, written by leading authorities in the field. It comprehensively addresses the theoretical aspects and applications of the valence bond method to chemical calculations.
| Clasificación: | Libro Electrónico |
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| Autor principal: | |
| Otros Autores: | |
| Formato: | Electrónico eBook |
| Idioma: | Inglés |
| Publicado: |
Hoboken, N.J. :
Wiley-Interscience,
©2008.
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| Temas: | |
| Acceso en línea: | Texto completo |
Tabla de Contenidos:
- A CHEMIST'S GUIDE TO VALENCE BOND THEORY; CONTENTS; PREFACE; 1 A Brief Story of Valence Bond Theory, Its Rivalry with Molecular Orbital Theory, Its Demise, and Resurgence; 2 A Brief Tour Through Some Valence Bond Outputs and Terminology; 3 Basic Valence Bond Theory; 4 Mapping Molecular Orbital--Configuration Interaction to Valence Bond Wave Functions; 5 Are the "Failures" of Valence Bond Theory Real?; 6 Valence Bond Diagrams for Chemical Reactivity; 7 Using Valence Bond Theory to Compute and Conceptualize Excited States.
- 8 Spin Hamiltonian Valence Bond Theory and its Applications to Organic Radicals, Diradicals, and Polyradicals9 Currently Available Ab Initio Valence Bond Computational Methods and their Principles; 10 Do Your Own Valence Bond Calculations--A Practical Guide; Epilogue; Glossary; Index.