Theoretical Treatment of Large Molecules and Their Interactions (eBook, PDF)

Part 4 Theoretical Models of Chemical Bonding
Redaktion: Maksic, Zvonimir B.

• Format: PDF

Produktbeschreibung

Numerous experts have contributed to a four-volume-set of books presenting the broad spectrum of contemporary theoretical chemistry. The first volume reviews methods for representing molecules in theoretical models. The introduction of further properties, like electronegativity and relativistic effects, to individual molecules and solids is reviewed in the second volume. Theoretical models for the interaction of molecules with radiation is the subject of Vol. 3. The last volume bridges the gap to biological systems with the theoretical models for the properties of large molecules.

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Produktdetails

• Verlag: Springer Berlin Heidelberg
• Seitenzahl: 458
• Erscheinungstermin: 7. März 2013
• Englisch
• ISBN-13: 9783642581830
• Artikelnr.: 53096850

Autorenporträt

Numerous experts have contributed to a four-volume-set of books presenting the broad spectrum of contemporary theoretical chemistry. The first volume reviews methods for representing molecules in theoretical models. The introduction of further properties, like electronegativity and relativistic effects, to individual molecules and solids is reviewed in the second volume. Theoretical models for the interaction of molecules with radiation is the subject of Vol. 3. The last volume bridges the gap to biological systems with the theoretical models for the properties of large molecules.

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.