Molecular Modeling of Inorganic Compounds

by Peter Comba and Trevor Hambley

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Book cover for Molecular Modeling of Inorganic Compounds

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In many branches of chemistry, Molecular Modeling is a well-established and powerful tool for the investigation of complex structures. The second completely revised and enlarged edition of this highly recognized book shows how this method can be successfully applied to inorganic and coordination compounds. The first part of the book gives a general introduction to Molecular Modeling, which will be of use for chemists in all areas. The second part discusses numerous carefully selected examples, chosen to illustrate the wide range of applicability of molecular modeling to metal complexes and the approaches being taken to dealing with some of the difficulties involved. While the general outline is similar to that of the first edition, many of the examples chosen for discussion reflect the changes of the past five years. In the third part, the reader learns how to apply Molecular Modeling to a new system and how to interpret the results. The accompanying software features 20 tutorial lessons based on examples from the literature and the book itself. The authors take special care to highlight possible pitfalls and offer advice on how to avoid them.
Therefore, this book will be invaluable to everyone working in or entering the field.
  • ISBN10 3527299157
  • ISBN13 9783527299157
  • Publish Date 16 January 2001 (first published 13 September 1995)
  • Publish Status Out of Print
  • Out of Print 7 October 2008
  • Publish Country DE
  • Imprint Wiley-VCH Verlag GmbH
  • Edition 2nd Revised edition
  • Format Hardcover
  • Pages 337
  • Language English