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Valence Bond Methods - Gordon A. Gallup

inglise keel
2015-11-24
190,33 € 317,22 €

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Saadetis 17-23 tööpäeva jooksul

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Valence bond theory is one of two commonly used methods in molecular quantum mechanics; the other is molecular orbital theory. This book focuses on the first of these methods: ab initio valence bond theory. The book is split into two parts. Part I gives simple examples of two-electron calculations and the necessary theory to extend these to larger systems. Part II gives a set of case studies of related mole ... Täielik kirjeldus

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Kirjeldus

Valence bond theory is one of two commonly used methods in molecular quantum mechanics; the other is molecular orbital theory. This book focuses on the first of these methods: ab initio valence bond theory. The book is split into two parts. Part I gives simple examples of two-electron calculations and the necessary theory to extend these to larger systems. Part II gives a set of case studies of related molecule sets designed to show the nature of the valence bond description of molecular structure. The book is of primary interest to researchers and students working on electronic theory and computation in chemistry and chemical physics.

Lisateave

Autor Gordon A. Gallup
Kirjastaja Cambridge University Press
Väljalaskeaasta 2015
Kaanetüüp Kõvakaaneline
EAN 9780521803922
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190,33 € 317,22 €