Chemical Modelling
Volume 15
1st Edition
Published on 22. November 2019
188 pages
978-1-78801-586-8 (ISBN)
Description
Chemical modelling covers a wide range of disciplines and this book is the first stop for any materials scientist, biochemist, chemist or molecular physicist wishing to acquaint themselves with major developments in the applications and theory of chemical modelling. Containing both comprehensive and critical reviews, it is a convenient reference to the current literature. Coverage includes, but is not limited to, boron clusters, molecular modeling of inclusion complexes, modelling of circular dichroism for DNA and proteins, and the interface effect of nanocomposites as electrode materials for Li/Na ion batteries.
More details
Series
Language
English
Place of publication
Cambridge
United Kingdom
Target group
Professional and scholarly
ISBN-13
978-1-78801-586-8 (9781788015868)
DOI
10.1039/9781788015868
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Schweitzer Classification
Other editions
Additional editions
Book
11/2019
Royal Society of Chemistry
€467.89
Shipment within 3-4 weeks
E-Book
11/2019
1st Edition
Royal Society of Chemistry
€432.99
Available for download
Persons
Content
Modeling Nanoparticle Aggregation;
Paths of Chemical Reactions and their Networks: From Geometry Optimization to Automated Search and Systematic Analysis;
Charge Transport through Nanocontacts;
Activation of Small Molecules by Transition-metal Complexes;
Modeling Electronic Excitations/Formation of Trap States in Semiconducting Nanocrystals
Paths of Chemical Reactions and their Networks: From Geometry Optimization to Automated Search and Systematic Analysis;
Charge Transport through Nanocontacts;
Activation of Small Molecules by Transition-metal Complexes;
Modeling Electronic Excitations/Formation of Trap States in Semiconducting Nanocrystals
