4.7 Article

Quasiclassical trajectory calculations of differential cross sections and product energy distributions for the N plus OH→NO plus H reaction

Journal

JOURNAL OF CHEMICAL PHYSICS
Volume 131, Issue 9, Pages -

Publisher

AMER INST PHYSICS
DOI: 10.1063/1.3218843

Keywords

atom-molecule collisions; atom-molecule reactions; nitrogen; oxygen compounds; reaction kinetics theory; rotational-vibrational energy transfer; vibrational states

Funding

  1. Pole de Sciences Planetaires of Bourgogne Franche-Comte

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A detailed quasiclassical trajectory on the N+OH(v=0, j=0,1,5,10)-> NO+H reaction is reported at four collision energies from 0.01 to 0.5 eV. The vibrational distributions which are statistical and the angular distributions, which present a forward/backward symmetry, are consistent with the formation of a long-lived intermediate complex. Our results show globally a weak dependence of the angular and rovibrational distributions on the rotational excitation of OH, but a more pronounced effect of the collision energy.

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