Hydrogen Bonding
Hydrogen Bonding
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Summary
Explains the literature in which the characteristics of hydrogen bonds have been probed by quantum chemical methods. After an explanation as to how various properties are calculated, this book describes the results that have been obtained in various systems, focusing on the energetics, equilibrium geometries, and vibrational spectras.
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Hydrogen Bonding by Steve Scheiner
Because of the importance of the hydrogen bond, there have been scores of insights gained about its fundamental nature by quantum chemical computations over the years. Such methods can probe subtle characteristics of the electronic structure and examine regions of the potential energy surface that are simply not accessible by experimental means. The maturation of the techniques, codes, and computer hardware have permitted calculations of unprecedented reliability and rivaling the accuracy of experimental data. This book strives first toward an appreciation of the power of quantum chemistry to analyse the deepest roots of the hydrogen bond phenomenon. It offers a systematic and understandable account of decades of such calculations, focusing on the most important findings. This book provides readers with the tools to understand the original literature, and to perhaps carry out some calculations of their very own on systems of interest.
..it provides a balanced overview of the quantum chemical framework...it is a rich compilation of information with lots of interesting results...this book should become a popular reference. * Structural Chemistry *
Steve Scheiner is the author of Molecular Interactions: From van der Waals to Strongly Bound Complexes, published by Wiley.
| SKU | Unavailable |
| ISBN 13 | 9780195090116 |
| ISBN 10 | 019509011X |
| Title | Hydrogen Bonding |
| Author | Steve Scheiner |
| Series | Topics In Physical Chemistry |
| Condition | Unavailable |
| Binding Type | Hardback |
| Publisher | Oxford University Press Inc |
| Year published | 1997-11-27 |
| Number of pages | 400 |
| Cover note | Book picture is for illustrative purposes only, actual binding, cover or edition may vary. |
| Note | Unavailable |