Structure and Bonding

Computational Studies in Organometallic Chemistry

Editors: Macgregor, Stuart A., Eisenstein, Odile (Eds.)

  • Overview chapters introduce the newcomer to the topic covered
  • Series covers hot topics of frontier research summarized by reputed scientists in the field
  • Volumes are useful and of relevance for a long period of time
see more benefits

Buy this book

eBook 190,39 €
price for Spain (gross)
  • ISBN 978-3-319-31638-3
  • Digitally watermarked, DRM-free
  • Included format: EPUB, PDF
  • ebooks can be used on all reading devices
  • Immediate eBook download after purchase
Hardcover 242,99 €
price for Spain (gross)
  • ISBN 978-3-319-31636-9
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
  • The final prices may differ from the prices shown due to specifics of VAT rules
About this book

The series Structure and Bonding publishes critical Reviews on Topics of Research concerned with chemical structure and bonding. The scope of the series spans the entire Periodic Table and addresses structure and bonding issues associated with all of the elements. It also focuses attention on new and developing areas of modern structural and theoretical chemistry such as nanostructures, molecular electronics, designed molecular solids, surfaces, metal clusters and supramolecular structures. Physical and spectroscopic techniques used to determine, examine and model structures fall within the purview of Structure and Bonding to the extent that the focus is on the scientific results obtained and not on specialist information concerning the techniques themselves. Issues associated with the development of bonding models and generalizations that illuminate the reactivity pathways and rates of chemical processes are also relevant.

The individual volumes in the series are thematic. The goal of each volume is to give the reader, whether at a university or in industry, a comprehensive overview of an area where new insights are emerging that are of interest to a larger scientific audience. Thus each review within the volume critically surveys one aspect of that topic and places it within the context of the volume as a whole. The most significant developments of the last 5 to 10 years should be presented using selected examples to illustrate the principles discussed. A description of the physical basis of the experimental techniques that have been used to provide the primary data may also be appropriate, if it has not been covered in detail elsewhere. The coverage need not be exhaustive in data, but should rather be conceptual, concentrating on the new principles being developed that will allow the reader, who is not a specialist in the area covered, to understand the data presented. Discussion of possible future research directions in the area is welcomed.

Table of contents (7 chapters)

  • Modelling and Rationalizing Organometallic Chemistry with Computation: Where Are We?

    Perrin, Lionel (et al.)

    Pages 1-37

    Preview Buy Chapter 30,19 €
  • Reactivities and Electronic Properties of Boryl Ligands

    Lin, Zhenyang

    Pages 39-58

    Preview Buy Chapter 30,19 €
  • QM/MM Calculations on Selectivity in Homogeneous Catalysis

    Jover, Jesús (et al.)

    Pages 59-79

    Preview Buy Chapter 30,19 €
  • Realistic Simulation of Organometallic Reactivity in Solution by Means of First-Principles Molecular Dynamics

    Vidossich, Pietro (et al.)

    Pages 81-106

    Preview Buy Chapter 30,19 €
  • Computation of Excited States of Transition Metal Complexes

    Almeida, Nuno M. S. (et al.)

    Pages 107-138

    Preview Buy Chapter 30,19 €

Buy this book

eBook 190,39 €
price for Spain (gross)
  • ISBN 978-3-319-31638-3
  • Digitally watermarked, DRM-free
  • Included format: EPUB, PDF
  • ebooks can be used on all reading devices
  • Immediate eBook download after purchase
Hardcover 242,99 €
price for Spain (gross)
  • ISBN 978-3-319-31636-9
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
  • The final prices may differ from the prices shown due to specifics of VAT rules
Loading...

Recommended for you

Loading...

Bibliographic Information

Bibliographic Information
Book Title
Computational Studies in Organometallic Chemistry
Editors
  • Stuart A. Macgregor
  • Odile Eisenstein
Series Title
Structure and Bonding
Series Volume
167
Copyright
2016
Publisher
Springer International Publishing
Copyright Holder
Springer International Publishing Switzerland
eBook ISBN
978-3-319-31638-3
DOI
10.1007/978-3-319-31638-3
Hardcover ISBN
978-3-319-31636-9
Series ISSN
0081-5993
Edition Number
1
Number of Pages
VII, 181
Topics