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Chemical Modelling: Volume 15 Editors: Michael Springborg, Jan-Ole Joswig


About this book

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.

From the book series:
SPR - Chemical Modelling

Book 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

The print version of this book is planned for release on 29 November 2019. Information about this book is subject to change without notice.

Pre-order hardback £314.95 *
* Exclusive of taxes
This book contains 188 pages.

Publication details

Copyright year: 2020
Print ISBN: 978-1-78801-369-7
ePub eISBN: 978-1-83916-158-2