Perspectives in Electronic Structure Theory

Name: Perspectives in Electronic Structure Theory
Brand: Springer-Verlag Berlin and Heidelberg GmbH & Co. KG
SKU: 9783642201790
Price: 157.63 EUR
Availability: InStock

Автор: Roman F. Nalewajski

Език:

Корици: С твърди корици

Издател: Springer-Verlag Berlin and Heidelberg GmbH & Co. KG

Наличност: Външен склад

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157.63 € 308.31 лв

The understanding in science implies insights from several different points of view. Alternative mod...

Информация за книгата

Автор

Roman F. Nalewajski

Език

Английски език

Корици

Книга - С твърди корици

Издадена

2012

страници

720

EAN

9783642201790

ISBN

3642201792

Enbook ID

01657703

Издател

Springer-Verlag Berlin and Heidelberg GmbH & Co. KG

Теглоt

1308

Размери

155 x 235 x 44

Пълно описание

The understanding in science implies insights from several different points of view. Alternative modern outlooks on electronic structure of atoms and molecules, all rooted in quantum mechanics, are presented in a single text. Together these complementary perspectives provide a deeper understanding of the localization of electrons and bonds, the origins of chemical interaction and reactivity behavior, the interaction between the geometric and electronic structure of molecules, etc. In the opening two parts the basic principles and techniques of the contemporary computational and conceptual quantum chemistry are presented, within both the wave-function and electron-density theories. This background material is followed by a discussion of chemical concepts, including stages of the bond-formation processes, chemical valence and bond-multiplicity indices, the hardness/softness descriptors of molecules and reactants, and general chemical reactivity/stability principles. The insights from Information Theory, the basic elements of which are briefly introduced, including the entropic origins and Orbital Communication Theory of the chemical bond, are the subject of Part IV. The importance of the non-additive (interference) information tools in exploring patterns of chemical bonds and their covalent and ionic components will be emphasized.

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Perspectives in Electronic Structure Theory

Информация за книгата

Пълно описание

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