Chemical Modelling: Applications and Theory Volume 7
Author:   Michael Springborg (University of Saarland, Germany) ,  Benoit Champagne ,  Leif A. Eriksson ,  Jan-Ole Joswig
Publisher:   Royal Society of Chemistry
Volume:   Volume 7
ISBN:  

9781847550750


Pages:   352
Publication Date:   05 October 2010
Format:   Hardback
Availability:   Out of print, replaced by POD   Availability explained
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Chemical Modelling: Applications and Theory Volume 7


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Author:   Michael Springborg (University of Saarland, Germany) ,  Benoit Champagne ,  Leif A. Eriksson ,  Jan-Ole Joswig
Publisher:   Royal Society of Chemistry
Imprint:   Royal Society of Chemistry
Volume:   Volume 7
Dimensions:   Width: 15.60cm , Height: 2.50cm , Length: 23.40cm
Weight:   1.471kg
ISBN:  

9781847550750


ISBN 10:   1847550754
Pages:   352
Publication Date:   05 October 2010
Audience:   Professional and scholarly ,  Professional & Vocational
Format:   Hardback
Publisher's Status:   Active
Availability:   Out of print, replaced by POD   Availability explained
We will order this item for you from a manufatured on demand supplier.

Table of Contents

Preface; Modelling Photochemical Pharmaceutics and Photodegrading; Proton transport; Polarizabilities and hyperpolarizabilities; Numerical Methods in Chemistry; Elongation method; Quantum Monte Carlo Methods; Neural Networks; Protein Folding; Mechanically Induced Chemistry: First-Principles Simulation; Nanoelectronics; Orbital Dependent Exact Exchange Methods in Denisty Functional Theory; Computer-Aided Drug Design

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Author Information

Prof. Dr. Michael Springborg heads up of the three groups in Physical Chemistry at the University of Saarland where the main activities concentrate on teaching and research. The major part of Prof. Dr. Michael Springborg's research concentrates on the development and application of theoretical methods, including accompanying computer programs, for the determination of materials properties. Quantum theory forms the theoretical foundation for most of our work. The materials of the group's interest range from atoms, via clusters and polymers, to solids. They study their structural, electronic, energetic, and opitcal properties.

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