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• W2051650880 abstract "The isomerization dynamics of a model of vibrationally excited trans-diimide are reported. Energy transfer into the torsional reaction coordinate does not proceed through the resonance processes described in a companion paper. Rather, a Coriolis coupling of the NH stretches to the torsion dominates the reaction when appropriate relative phase relationships are satisfied. Large amounts of energy can be transferred in this process; thus isomerization is observed in as few as three NH stretching periods. Furthermore, the phase relationships appropriate for isomerization are very restrictive, so that a surprisingly well defined average behavior exists for several vibrational periods both prior to and after the reactive event. We have identified a specific dynamic mechanism responsible for trans/cis isomerization and for trapping the reactive trajectories in the cis-configuration. Despite the complexity of this six degrees of freedom model system, the reactive dynamics can be described in a simple manner." @default.
• W2051650880 created "2016-06-24" @default.
• W2051650880 creator A5018668830 @default.
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• W2051650880 date "1988-01-01" @default.
• W2051650880 modified "2023-09-26" @default.
• W2051650880 title "Classical dynamics of an internal Coriolis-induced isomerization of <i>t</i> <i>r</i> <i>a</i> <i>n</i> <i>s</i>-diimide" @default.
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• W2051650880 doi "https://doi.org/10.1063/1.454651" @default.
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