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OverviewThe accurate determination of the structure of molecular systems provides information about the consequences of weak interactions both within and between molecules. These consequences impact the properties of the materials and the behaviour in interactions with other substances. This book presents modern experimental and computational techniques for the determination of molecular structure. It also highlights applications ranging from the simplest molecules to DNA and industrially significant materials. Full Product DetailsAuthor: Aldo Domenicano , Istvan HargittaiPublisher: Springer-Verlag New York Inc. Imprint: Springer-Verlag New York Inc. Edition: Softcover reprint of the original 1st ed. 2002 Volume: 68 Dimensions: Width: 15.50cm , Height: 2.20cm , Length: 23.50cm Weight: 1.330kg ISBN: 9781402007101ISBN 10: 1402007108 Pages: 417 Publication Date: 30 June 2002 Audience: College/higher education , Professional and scholarly , Undergraduate , Postgraduate, Research & Scholarly Format: Paperback Publisher's Status: Active Availability: In Print  This item will be ordered in for you from one of our suppliers. Upon receipt, we will promptly dispatch it out to you. For in store availability, please contact us. Table of Contents1. X-Ray Crystallography: A History of Ideas.- 2. Microwave Spectroscopy.- 3. Infrared Spectroscopy.- 4. Gas-Phase Electron Diffraction.- 5. A Spectroscopist’s View on the Structural Problem.- 6. Aspects of Structural Chemistry in Molecular Biology.- 7. Magic and Mysteries of Modern Molecular Dynamics Simulations. A Basic Introduction.- 8. Phases, Phase Changes, and the Thermodynamics of Small Systems.- 9. Relativistic Effects in Molecular Structure of s- and p-Block Elements.- 10. Metal Halide Molecular Structures.- 11. Strength from Weakness: Inorganic Structures.- 12. The Myth about Planarity of Olefinic Carbon Atoms: An ab Initio Study.- 13. Polymorphism.- 14. Hydrogen Bond at the Dawn of the XXI Century. New Methods, New Results, New Ideas.- 15. Improper, Blue-Shifting Hydrogen Bond: Theory and Experiment.- 16. From Molecules to Supermolecules: A Theoretical Approach.- 17. Strength from Motion in Crystals: The Example of Supramolecular Adducts.- 18. Crystal Engineering from Weakness to Strength — An Overview.- 19. Controlling Molecular Synthesis in the Solid State Using Linear Templates.- 20. Ab Initio Molecular Dynamical Simulation on H2 Adsorption and Storage in Carbon-Based Materials.- 21. First-Principles Studies on Heterogeneous Catalysis of Amination: Mechanisms and Support Effects.ReviewsAuthor InformationTab Content 6Author Website:Countries AvailableAll regions |
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