Molecular Interactions - From Van Der Waals to Strongly Bound Complexes

Informationen zum Autor Steve Scheiner is the author of Molecular Interactions: From van der Waals to Strongly Bound Complexes, published by Wiley. Klappentext Zwischen Molekülen können Kräfte sehr unterschiedlicher Stärke wirken. Hier finden Sie eine Einführung in die theoretische Behandlung aller dieser Kräfte - von schwach gebundenen van-der-Waals-Komplexen bis zur sehr starken interionischen Wechselwirkung - anhand vieler Beispiele. Sie lernen, wie Sie für jedes Problem die richtige Methode auswählen können. Zusammenfassung This text provides an introduction to the theoretical methods that are used to analyze each sort of force and provide the reader with a guide to the most appropriate method for a given problem. Examples are used to illustrate the points, and the pitfalls that a novice might encounter are outlined. Inhaltsverzeichnis Aus dem Inhalt: Symmetry - Adapted Peturbation Theory of Intermolecular Interactions; Ab Initio Studies of Nonadditive Interactions; Basis Set Superposition Error; Theory and Computation of Vibration, Rotation, and Tunnelling of van der Waals Complexes and Their Spectra; The Quest for Reliability in Calculated Properties of Hydrogen-Bonded Complexes; Ab Initio Predictions of the Vibrational Spectra of some Molecular Complexes. Comparison with Experiment; Conventional and Unconventional Hydrogen-Bonded Ionic Cluster; Case Studies on Cooperativity in Hydrogen-Bonded Clusters and Polymers; Neutral Chain-Like and Cyclic Clusters of Hydrogen Fluoride and Hydrogen Cyanide and Charged Defects on Chain-Like Hydrogen Fluoride Oligomers; Electrostatic Forces in Molecular Interactions. @d:READERSHIP Advanced Graduate Students and Researchers

Product details

• Authors: S Scheiner, Steve Scheiner, Steve (Southern Illinois University) Scheiner, Scheiner Steve
• Assisted by: Stev Scheiner (Editor), Steve Scheiner (Editor), Scheiner Steve (Editor)
• Publisher: Wiley, John and Sons Ltd
• Languages: English
• Product format: Hardback
• Released: 25.03.1997
• EAN: 9780471971542
• ISBN: 978-0-471-97154-2
• No. of pages: 378
• Series: Wiley Series in Theoretical Chemistry; Wiley Series in European Law; Wiley Series in Theoretical Chemistry; Wiley Theoretical Chemistry
• Subjects: Natural sciences, medicine, IT, technology > Chemistry > Physical chemistry; Chemie, Physikalische Chemie, chemistry, Physical Chemistry, Atomic and Molecular Physics, Molekulardynamik