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Reactive island theory unimolecular reaction rate

With this brief overview of classical theories of unimolecular reaction rate, one might wonder why classical mechanics is so useful in treating molecular systems that are microscopic, and one might question when a classical statistical theory should be replaced by a corresponding quantum theory. These general questions bring up the important issue of quantum-classical correspondence in general and the field of quantum chaos [27-29] (i.e., the quantum dynamics of classically chaotic systems) in particular. For example, is it possible to translate the above classical concepts (e.g., phase space separatrix, NHIM, reactive islands) into quantum mechanics, and if yes, how What is the consequence of... [Pg.7]


See other pages where Reactive island theory unimolecular reaction rate is mentioned: [Pg.7]    [Pg.587]    [Pg.120]    [Pg.152]   


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