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Reactive Islands Kinetic Theory

Although the full -blown reactive islands theoretical prediction of the [Pg.157]

The correction a, which does not seem to have been as well discussed in the literature, is calculated according to the formula [Pg.158]

Implicit in the application of reactive islands theory, or in the application of other models of reaction dynamics that make use of the properties of a reaction separatrix, is the idea that the chaotic phase space may be considered to be completely structureless (within the restrictions imposed by the homoclinic/heteroclinic tangling of the separatrix manifolds). However, the presence of internal bottlenecks within one or more isomers may cause this approximation to break down.2 io3-i05,iu Accurate procedures for developing corrections to account for internal bottlenecks in two-dimensional systems have been developed. - 2 Unfortunately, much progress remains to be made toward developing quantitative procedures for dealing with internal bottlenecks in many-dimensional systems. [Pg.159]


N. De Leon, /. Chem. Phys., 96, 285 (1991). Cylindrical Manifolds and Reactive Island Kinetic Theory in the Time Domain. [Pg.174]


See other pages where Reactive Islands Kinetic Theory is mentioned: [Pg.587]    [Pg.156]    [Pg.587]    [Pg.156]    [Pg.157]    [Pg.158]    [Pg.120]    [Pg.37]   


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