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Quasiperiodic trajectories for a multidimensional anharmonic classical Hamiltonian excited above the unimolecular threshold

Authors: Ralph J. Wolf; William L. Hase;

Quasiperiodic trajectories for a multidimensional anharmonic classical Hamiltonian excited above the unimolecular threshold

Abstract

Classical trajectories are used to investigate the internal dynamics of the model molecule H–C–C. Two different anharmonic potential energy surfaces which exhibit intrinsic non-RRKM lifetimes are found to contain a large number of quasiperiodic trajectories at energies in excess of H–C–C→H+C=C dissociation threshold. Rotational excitation of H–C–C does not destroy the quasiperiodic motion. The quasiperiodic trajectories are displayed by projections into different coordinate planes and by surfaces of section. The relationship of these results to unimolecular rate theory is briefly discussed.

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
79
Average
Top 10%
Top 10%
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