Format:
Online-Ressource
,
v.: digital
Edition:
Online-Ausg. 2005 Springer eBook Collection. Chemistry and Materials Science
ISBN:
9781402021657
Series Statement:
NATO Science Series II: Mathematics, Physics and Chemistry, II. Mathematics, Physics and Chemistry 145
Content:
The theoretical treatment of chemical reaction dynamics has undergone spectacular development during the last few years, prompted by experimental progress. Beam production, spectroscopic detection using high resolution, polarized lasers allowing energy and angular momentum selection, etc. have advanced so much that the experiments now offer detailed scattering information for theory to explain and rationalize. At the same time, advances in computing and networking technologies for heterogeneous and grid environments afford new possibilities for theoretical studies of chemical reactivity. As a
Note:
Description based upon print version of record
,
Preliminaries; PREFACE; CONTENTS; Asymptotic interactions between open shell partners in low temperature; Differential cross sections for abstraction reactions of halogen atoms with molecular hydrogen including nonadiabatic effects; On the quantization of the electronic non adiabatic coupling terms the H H system as a case study; Non-adiabatic dynamics in the O+H2 reaction; Nonadiabatic transitions between asymptotically degenerate states; Coupling of electron momenta in ion atom collisions; Time dependent wavepacket calculations for reactive scattering and photodissociation
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Quantum dynamics of insertion reactionsChebyshev propagation and applications to scattering problems; Molecular dynamics energy selected bases; Molecular reaction stereodynamics in search of paths to overcome steric hindrances to reactivity; Vibrational predissociation quasiclassical tunneling through classical chaotic sea; Some recent advances in the modeling of ion molecule association reactions; Vibrational relaxation of diatoms in collisions with atoms at very low energies; Collisional energy transfer in the gas phase by classical trajectory calculations
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Manipulation of atoms and molecules with laser radiation and external fieldsPhotodissociation of hydrogen halides in a cryogenic rare gas environment a complex approach to simulations of cluster experiments; Index;
Additional Edition:
ISBN 9781402020551
Additional Edition:
Erscheint auch als Druck-Ausgabe Theory of Chemical Reaction Dynamics Proceedings of the NATO Advanced Research Workshop, held in Balatonföldvár, Hungary, 8-12 June 2003
Language:
English
DOI:
10.1007/1-4020-2165-8
URL:
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