Electron Density and Chemical Bonding II, Dietmar Stalke

Автор: Pettifor, D.g.
Название: Bonding and structure of molecules and solids
ISBN: 0198517866 ISBN-13(EAN): 9780198517863
Издательство: Oxford Academ
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Цена: 54910.00 T
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Описание: This volume explains the observed trends in the bonding and structure of molecules and solids within the framework of simple but predictive models that are based on the modern real-space approach to the electronic structure. It is directed at final year undergraduates and first year postgraduates in physics, chemistry, and materials science.

Автор: Wolfram Koch
Название: A Chemist`s Guide to Density Functional Theory, 2nd Edition
ISBN: 3527303723 ISBN-13(EAN): 9783527303724
Издательство: Wiley
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Цена: 86590.00 T
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Описание: Many use Density Functional Theory (DFT) programs as black-box tools without having a quantum theoretical background or a concise knowledge about the strength and weaknesses of this approach. This text is designed to bridge the gap and to guide the non-expert user.

Автор: Winter Mark
Название: Chemical Bonding
ISBN: 0198700954 ISBN-13(EAN): 9780198700951
Издательство: Oxford Academ
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Цена: 38010.00 T
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Описание: Chemical bonding, which underlies the structure and reactivity of all molecules, is explained beautifully clearly and succinctly in this primer, making it the perfect text to introduce students to this fundamental aspect of chemistry.

Автор: Dietmar Stalke
Название: Electron Density and Chemical Bonding I
ISBN: 3642439055 ISBN-13(EAN): 9783642439056
Издательство: Springer
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Цена: 243800.00 T
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Описание: Overgaard: Charge Density Methods in Hydrogen Bond Studies.-U. Stalke: Some Main Group Chemical Perceptions in the Light of Experimental Charge Density Investigations.-D. Hauf: On the Nature of ss-Agostic Interactions: A Comparison Between the Molecular Orbital and Charge Density Picture.