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Electron Dynamics in Molecular Interactions: Principles and Applications de FRANK HAGELBERG

Electron Dynamics in Molecular Interactions: Principles and Applications

Autor FRANK HAGELBERG
en Limba Engleză Hardback – 22 dec 2013
Offers a comprehensive introduction into the theory of nonadiabatic molecular processes - an expanding segment of molecular quantum dynamics. This title intends to provide a synoptic presentation of some theoretical efforts and to contrast them with the more traditional models of nonadiabatic molecular processes.
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Specificații

ISBN-13: 9781848164871
ISBN-10: 1848164874
Pagini: 968
Ilustrații: Illustrations (black and white)
Dimensiuni: 165 x 231 x 43 mm
Greutate: 1.63 kg
Ediția:New.
Editura: Imperial College Press

Cuprins

Introduction: The Nonadiabatic Problem in Molecular Dynamics; Ab Initio Theory of Electronic Structure; The Adiabatic and the Diabatic Representation; Semiclassical Notions; Basic Concepts of Scattering Theory; The Time Independent Theory of Molecular Collisions I: Multichannel Scattering; The Time Independent Theory of Molecular Collisions II: The Electronic Problem; Time Dependent Hartree-Fock Theory; Electron Nuclear Dynamics; The Classical Electron Analog; The Initial Value Representation; Hopping and Spawning; Quantum Fluid Dynamics; Wavepacket Propagation; The Liouville Formalism; Decoherence; Electron Dynamics in Nonlinear Spectroscopy; Nonadiabatic Phenomena in Molecule-Surface Interactions; Electron Transfer in Condensed Matter Systems; Coherent Control of Molecular Processes.