Téléchargez le livre : Nonlinear Hamiltonian Mechanics Applied to Molecular Dynamics

Nonlinear Hamiltonian Mechanics Applied to Molecular Dynamics

Theory and Computational Methods for Understanding Molecular Spectroscopy and Chemical Reactions de

Éditeur :

Springer


Collection :

SpringerBriefs in Molecular Science

Paru le : 2014-09-22

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Description

This brief presents numerical methods for describing and calculating invariant phase space structures, as well as solving the classical and quantum equations of motion for polyatomic molecules. Examples covered include simple model systems to realistic cases of molecules spectroscopically studied.
Vibrationally excited and reacting molecules are nonlinear dynamical systems, and thus, nonlinear mechanics is the proper theory to elucidate molecular dynamics by investigating invariant structures in phase space. Intramolecular energy transfer, and the breaking and forming of a chemical bond have now found a rigorous explanation by studying phase space structures.
Pages
158 pages
Collection
SpringerBriefs in Molecular Science
Parution
2014-09-22
Marque
Springer
EAN papier
9783319099873
EAN EPUB
9783319099880
Informations sur l'ebook
Nombre pages copiables
1
Nombre pages imprimables
15
Taille du fichier
2826 Ko
Prix
52,74 €

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