Perspectives in Electronic Structure Theory

Name: Perspectives in Electronic Structure Theory
Brand: Springer-Verlag Berlin and Heidelberg GmbH & Co. KG
SKU: 9783642201790
Price: 58978 HUF
Availability: InStock

Szerző: Roman F. Nalewajski

Nyelv:

Kötés: Kemény kötésű

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

Elérhetőség: Beszállítói készleten

Küldés 10-13 napon belül

58 978 Ft

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

Információk a könyvről

Szerző

Roman F. Nalewajski

Nyelv

Angol

Kötés

Könyv - Kemény kötésű

Kiadva

2012

oldal

720

EAN

9783642201790

ISBN

3642201792

Enbook ID

01657703

Kiadó

Springer-Verlag Berlin and Heidelberg GmbH & Co. KG

Súly

1308

Méretek

155 x 235 x 44

Teljes leírás

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

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