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Ab Initio Direct (Chemical) Dynamics Nonadiabatic Reactions X Statistical Methods X

Ab Initio Direct (Chemical) Dynamics Nonadiabatic Reactions X Statistical Methods X Adiabatic Reactions . What do we want to know?. Products Rate coefficients, reaction cross sections, initial state dependence, final state distribution, state to state cross sections, Mechanism.

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Freedom changes - PowerPoint PPT Presentation

Ab Initio Direct (Chemical) Dynamics Nonadiabatic Reactions X Statistical Methods X