The theoretical treatment of low-energy e<sup>+</sup>-H<sub>2</sub> scattering using the Kohn variational method
E A G Armour; D J Baker; M Plummer; E A G Armour; Dept. of Math., Nottingham Univ., UK; D J Baker; Dept. of Math., Nottingham Univ., UK; M Plummer; Dept. of Math., Nottingham Univ., UK
Журнал:
Journal of Physics B: Atomic, Molecular and Optical Physics
Дата:
1990-09-14
Аннотация:
The authors present calculations of e<sup>+</sup>-H<sub>2</sub> scattering below the positronium formation threshold at 8.63 eV for the Sigma <sub>g</sub><sup>+</sup>, Sigma <sub>u</sub><sup>+</sup>, Pi <sub>u</sub> and Pi <sub>g</sub> symmetries using the generalized Kohn method. Mixing of the two lowest partial waves is allowed for in the Sigma <sub>g</sub><sup>+</sup>, Sigma <sub>u</sub><sup>+</sup> and Pi <sub>u</sub> symmetries, using a two channel K-matrix. Comparisons with Kohn calculations of the lowest partial waves of these symmetries show that mixing of partial waves has a relatively small effect on the contributions to the total scattering cross section at the energies considered. The Pi <sub>g</sub> calculation includes only the lowest partial wave. As well as separable short-range correlation functions, the trial functions used in these calculations include Hylleraas-type functions containing the positron-electron distance as a linear factor and functions appropriate for taking into account long-range polarization of the hydrogen molecule.
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