Trends in Applied Theoretical Chemistry

The present volume gathers a series of selected and updated contributions presented at the International Symposium on Applied Theoretical Chemistry held in Havana, Cuba, July 2-6, 1990. This Symposium was intended to illustrate current applications of Theoretical Chemistry in different fields of Phy...

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Bibliographic Details
Other Authors: Montero, L.A. (Editor), Smeyers, Y.G. (Editor)
Format: eBook
Language:English
Published: Dordrecht Springer Netherlands 1992, 1992
Edition:1st ed. 1992
Series:Topics in Molecular Organization and Engineering
Subjects:
Online Access:
Collection: Springer Book Archives -2004 - Collection details see MPG.ReNa
Table of Contents:
  • I: Atom-Surface Interactions
  • Chemisorption on Metal Surfaces. A Cluster Model Approach
  • Elastic Scattering of Atoms from Solid Surfaces. The 4He-Cu(11?) (? = 0,3,5,7) Example
  • II: Chemical Reaction Mechanisms
  • Large Prediction of Rate Constants of Polyatomic Reactions: Permanent Challenge to Theoretical Chemists
  • An Application of Theoretical Models to Understand Chemical Reactions: The Electrophilic Substitution in Furan
  • SINDO1 Study of the Photoreaction of Tetramethylene Sulfide
  • Theoretical Approaches to Structural Stability and Shape Stability Along Reaction Paths
  • III: Molecular Structure and Properties
  • Structure of Molecules: Experiments and Theory
  • A Theoretical Study of Histamine Monocation and Some Derivatives as H2-Receptor Agonists
  • Delocalization Mechanism of Ferromagnetic Exchange Interactions in the Complexes of Cu(II) with Nitroxyl Radicals
  • Theoretical Aspects of Electroactive Polymers
  • IV: Molecular Spectroscopy
  • Theoretical Approaches to the Vibrational Spectra of Polyatomic Molecules
  • Theoretical Approach to Torsional Band Structures of Some Non-Rigid Molecules