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Stereodynamics of O(3P)+H2 at Scattering Energies of 0.5, 0.75, and 1.0 eV
Authors:Victor Wei-keh Wu
Institution:Department of Chemical and Materials Engineering, National Kaohsiung University of Applied Sci-ences, Kaohsiung 80782;Victor Basic Research Laboratory e. V. Gadderbaumer-Str. 22, D-33602 Bielefeld, Germany
Abstract:Quasiclassical trajectory calculation of the title reaction O(3P)+H2→OH+H at three different scattering energies of 0.5, 0.75, and 1.0 eV on the lowest electronic potential energy surface 13A" has been done. Distribution P(θr) of polar angles between the relative velocityk of the reactant and rotational angular momentum vector j' of the product, distribution P(φr) of the azimuthal as well as dihedral angles correlating k-k'-j', 3-dimensional distri-bution, and polarization-dependent differential cross sections (PDDCSs)dependent upon the scattering angle of the product molecule OH between the relative velocity k of the reactant and k' of the product at different scattering energies of 0.5, 0.75, and 1.0 eV are presented and discussed.
Keywords:Quasiclassical trajectory calculation  Stereodynamics  Alignment  Rotational angular momentum  Polarization-dependent differential cross section  O+H2 reaction
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