Reaction dynamics of O(1D)+HD. I. The insertion pathway

The doubly differential cross sections (angle and speed) for the reactions O(1D)+HD→OH(OD)+D(H) at Ec=2.05 kcal/mol were directly mapped out using the Doppler-selected time-of-flight technique in a crossed-beam experiment. Except for the previously noted discrepancy in the H/D isotope branching rati...

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Veröffentlicht in:The Journal of chemical physics 1999-11, Vol.111 (17), p.7921-7930
Hauptverfasser: Hsu, Yen-Tsung, Liu, Kopin, Pederson, Lisa A., Schatz, George C.
Format: Artikel
Sprache:eng
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Zusammenfassung:The doubly differential cross sections (angle and speed) for the reactions O(1D)+HD→OH(OD)+D(H) at Ec=2.05 kcal/mol were directly mapped out using the Doppler-selected time-of-flight technique in a crossed-beam experiment. Except for the previously noted discrepancy in the H/D isotope branching ratio, good agreement with QCT (quasiclassical trajectory) results on a high quality ab initio surface are found for all dynamical features, including the product angular and translational energy distributions and the very detailed angle-specific translational energy release.
ISSN:0021-9606
1089-7690
DOI:10.1063/1.480127