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Valence bond methods : theory and applications /
This book focuses on ab initio valence bond theory. Part I gives examples of two-electron calculations and the necessary theory to extend these to larger systems. Part II discusses a series of case studies. Reference is made throughout to the freely available CRUNCH computer program for molecular st...
| Clasificación: | Libro Electrónico |
|---|---|
| Autor principal: | |
| Formato: | Electrónico eBook |
| Idioma: | Inglés |
| Publicado: |
Cambridge ; New York :
Cambridge University Press,
2002.
|
| Temas: | |
| Acceso en línea: | Texto completo |
MARC
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| 100 | 1 | |a Gallup, Gordon A. |q (Gordon Alban), |d 1927- | |
| 245 | 1 | 0 | |a Valence bond methods : |b theory and applications / |c Gordon A. Gallup. |
| 260 | |a Cambridge ; |a New York : |b Cambridge University Press, |c 2002. | ||
| 300 | |a 1 online resource (xv, 238 pages) : |b illustrations | ||
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| 504 | |a Includes bibliographical references (pages 231-233) and index. | ||
| 588 | 0 | |a Print version record. | |
| 505 | 0 | |a Cover; Half-title; Title; Copyright; Dedication; Contents; Preface; List of abbreviations; Part I Theory and two-electron systems; Part II Examples and interpretations; References; Index. | |
| 520 | |a This book focuses on ab initio valence bond theory. Part I gives examples of two-electron calculations and the necessary theory to extend these to larger systems. Part II discusses a series of case studies. Reference is made throughout to the freely available CRUNCH computer program for molecular structure calculations. | ||
| 546 | |a English. | ||
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