Victor Wei-keh Wu. Stereodynamics of O(3P)+H2 at Scattering Energies of 0.5, 0.75, and 1.0 eV[J]. Chinese Journal of Chemical Physics , 2010, 23(2): 149-154. doi: 10.1088/1674-0068/23/02/149-154
Citation: Victor Wei-keh Wu. Stereodynamics of O(3P)+H2 at Scattering Energies of 0.5, 0.75, and 1.0 eV[J]. Chinese Journal of Chemical Physics , 2010, 23(2): 149-154. doi: 10.1088/1674-0068/23/02/149-154

Stereodynamics of O(3P)+H2 at Scattering Energies of 0.5, 0.75, and 1.0 eV

doi: 10.1088/1674-0068/23/02/149-154
Funds:  The author wishes to thank Professor Ke-li Han of the Dalian Institute of Chemical Physics of the Chinese Academy of Sciences to provide the QCT-PDDCS code.This work was also financially supported by the Dalian Institute of Chemical Physics of the Chinese Academy of Sciences and Victor Basic Research Laboratory e.V. in Bielefeld, Germany.
  • Received Date: 2010-12-25
  • 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.
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Stereodynamics of O(3P)+H2 at Scattering Energies of 0.5, 0.75, and 1.0 eV

doi: 10.1088/1674-0068/23/02/149-154
Funds:  The author wishes to thank Professor Ke-li Han of the Dalian Institute of Chemical Physics of the Chinese Academy of Sciences to provide the QCT-PDDCS code.This work was also financially supported by the Dalian Institute of Chemical Physics of the Chinese Academy of Sciences and Victor Basic Research Laboratory e.V. in 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.

Victor Wei-keh Wu. Stereodynamics of O(3P)+H2 at Scattering Energies of 0.5, 0.75, and 1.0 eV[J]. Chinese Journal of Chemical Physics , 2010, 23(2): 149-154. doi: 10.1088/1674-0068/23/02/149-154
Citation: Victor Wei-keh Wu. Stereodynamics of O(3P)+H2 at Scattering Energies of 0.5, 0.75, and 1.0 eV[J]. Chinese Journal of Chemical Physics , 2010, 23(2): 149-154. doi: 10.1088/1674-0068/23/02/149-154

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