Stereodynamics of O(3P)+H2 at Scattering Energies of 0.5, 0.75, and 1.0 eV
- Received Date: 2010-12-25
- Quasiclassical trajectory calculation, Stereodynamics, Alignment, Rotational angular momentum, Polarization-dependent differential cross section, O+H2 reaction
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.
|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|