Theoretical Models of Chemical Bonding

Part 4: Theoretical Treatment of Large Molecules and Their Interactions
Mitarbeit: Angyan, J.G.; Avoird, A. van der; Baerends, E.J.; Bonaccorsi, R.; Brooks, C.L. III; Herausgegeben von Maksic, Zvonimir B.

• Broschiertes Buch

Produktbeschreibung

The state-of-the-art in contemporary theoretical chemistry is presented in this 4-volume set with numerous contributions from the most highly regarded experts in their field. It provides a concise introduction and critical evaluation of theoretical approaches in relation to experimental evidence.

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Produktdetails

• Verlag: Springer / Springer Berlin Heidelberg / Springer, Berlin
• Artikelnr. des Verlages: 978-3-642-63492-5
• 1991
• Seitenzahl: 472
• Erscheinungstermin: 1. November 2012
• Englisch
• Abmessung: 242mm x 170mm x 26mm
• Gewicht: 806g
• ISBN-13: 9783642634925
• ISBN-10: 3642634923
• Artikelnr.: 40770768

Inhaltsangabe

Chemical Fragmentation Approach to the Quantum Chemical Description of Extended Systems.- Semiclassical Methods for Large Molecules of Biological Importance.- Electronic Excited States of Biomolecular Systems: Ab Initio FSGO-based Quantum Mechanical Methods with Applications to Photosynthetic and Related Systems.- Classical Electrostatics in Molecular Interactions.- Weak Interactions Between Molecules and Their Physical Interpretation.- Ab Initio Studies of Hydrogen Bonding.- The Extramolecular Electrostatic Potential An Indicator of the Chemical Reactivity.- Curve Crossing Diagrams as General Models for Chemical Reactivity and Structure.- Orbital Interactions and Chemical Reactivity of Metal Particles and Metal Surfaces.- Intermolecular Forces and the Properties of Molecular Solids.- Theoretical Evaluation of Solvent Effects.