Theory of Chemical Reaction Dynamics | ISBN 9781402021657

Theory of Chemical Reaction Dynamics

herausgegeben von Antonio Laganà und György Lendvay
Mitwirkende
Herausgegeben vonAntonio Laganà
Herausgegeben vonGyörgy Lendvay
Buchcover Theory of Chemical Reaction Dynamics  | EAN 9781402021657 | ISBN 1-4020-2165-8 | ISBN 978-1-4020-2165-7
Leseprobe

Theory of Chemical Reaction Dynamics

herausgegeben von Antonio Laganà und György Lendvay
Mitwirkende
Herausgegeben vonAntonio Laganà
Herausgegeben vonGyörgy Lendvay

Inhaltsverzeichnis

Asymptotic Interactions Between Open Shell Partners in Low Temperature Complex Formation: The H(X2S1/2) + O2 (X3? g?) and $$ O({}^3P_{j_O } ) + OH(X^2 \Pi _{\tilde \Omega } )$$ Systems.- 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+H2 System as a Case Study.- Non-Adiabatic Dynamics in the O+H2 Reaction: A Timeindependent Quantum Mechanical Study.- Nonadiabatic Transitions Between Asymptotically Degenerate States.- Coupling of Electron Momenta in Ion-Atom Collisions.- Time-Dependent Wavepacket Calculations for Reactive Scattering and Photodissociation.- Quantum Dynamics of Insertion Reactions.- Chebyshev Propagation and Applications to Scattering Problems.- Molecular Dynamics: Energy Selected Bases.- Molecular Reaction Stereodynamics: In Search of Paths to Overcome Steric Hindrances to Reactivity.- The Rotating Bond Umbrella Model Applied to Atom-Methane Reactions.- Reaction Dynamics of Polyatomic Systems: FROM A + BCD ? AB + CD to X + YCZ3 ? XY + CZ3.- Strong Acceleration of Chemical Reactions Arising Through the Effects of Rotational Excitation of Reagents on Collision Geometry.- Dynamics Studies of the O(3P) + Ch4, C2H6 and C3H8 Reactions.- Quasiclassical Trajectory Studies of the Dynamics of Bimolecular Reactions of Vibrationally Highly Excited Molecules.- Towards a Grid Based Universal Molecular Simulator.- 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 byClassical Trajectory Calculations.- Manipulation of Atoms and Molecules with Laser Radiation and External Fields.- Photodissociation of Hydrogen Halides in a Cryogenic Rare Gas Environment: A Complex Approach to Simulations of Cluster Experiments.