Chemical Modelling: Volume 12
Author:   Michael Springborg (University of Saarland, Germany) ,  Jan-Ole Joswig (Dresden University of Technology, Germany) ,  Jean Christophe Tremblay ,  Mathieu Salanne
Publisher:   Royal Society of Chemistry
Volume:   Volume 12
ISBN:  

9781782621157


Pages:   362
Publication Date:   18 November 2015
Format:   Hardback
Availability:   In Print   Availability explained
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Chemical Modelling: Volume 12


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Overview

Chemical Modelling covers a wide range of disciplines and this Specialist Periodical Report is the first stop for any materials scientist, biochemist, chemist or molecular physicist wishing to acquaint themselves with major developments and current opinion in the applications and theory of chemical modelling. The topics covered are wide ranging with authors writing on clusters to modelling nanotubes and dynamics. Containing both comprehensive and critical reviews, this volume is an essential resource and convenient reference for any research group active in the field or chemical sciences library.

Full Product Details

Author:   Michael Springborg (University of Saarland, Germany) ,  Jan-Ole Joswig (Dresden University of Technology, Germany) ,  Jean Christophe Tremblay ,  Mathieu Salanne
Publisher:   Royal Society of Chemistry
Imprint:   Royal Society of Chemistry
Volume:   Volume 12
Dimensions:   Width: 15.60cm , Height: 3.00cm , Length: 23.40cm
Weight:   0.696kg
ISBN:  

9781782621157


ISBN 10:   1782621156
Pages:   362
Publication Date:   18 November 2015
Audience:   Professional and scholarly ,  Professional & Vocational
Format:   Hardback
Publisher's Status:   Active
Availability:   In Print   Availability explained
This item will be ordered in for you from one of our suppliers. Upon receipt, we will promptly dispatch it out to you. For in store availability, please contact us.

Table of Contents

Preface; Toward accurate coarse-graining approaches for protein and membrane simulations; Chemical bonding in solids: recovering chemical concepts in the realm of infinite periodic structures; Vibrational quantum dynamics at metallic surfaces; Theoretical studues of supercapcitors; Nanotubes with well-defined structure: imogolites; Application of DFT modeling in Fischer-Tropsch synthesis over Co-based catalysts; Structure prediction and its applications in computational materials design; Ab initio global optimization of clusters; Nitrogen- and phosphine-binding ligands in interaction with gold atoms, clusters, nanoparticles and surfaces

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