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Phys. Rev. A 80, 052704 (2009) [6 pages]

Electron scattering with a SiF2 molecule using the R-matrix method

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Hema Munjal and K. L. Baluja
Department of Physics and Astrophysics, University of Delhi, Delhi 110007, India

Received 24 August 2009; published 6 November 2009

Differential, integral, and momentum-transfer cross sections for the elastic scattering of electrons by SiF2 have been calculated for the incident electron energy range of 0–10 eV. These results are obtained by using the R-matrix method. The close-coupling expansion of the wave function of the scattering used in the R-matrix formalism includes the lowest six target states. We have also calculated the excitation cross sections from the ground state X1A1 to the first five excited states 3B1, 1B1, 3B2, 3A1, and 1B2 from their respective thresholds up to 10 eV. The target states are represented by configuration-interaction wave functions that account for correlation effects. We detect a shape resonance in 2B1 symmetry and a core-excited shape resonance in 2A2 symmetry. We have included up to g-partial waves in the scattering calculation. For this polar molecule, higher partial wave contribution is accounted for by invoking a Born-closure approximation. Elastic cross-section results are compared with the other theoretical works available.

© 2009 The American Physical Society

URL:
http://link.aps.org/doi/10.1103/PhysRevA.80.052704
DOI:
10.1103/PhysRevA.80.052704
PACS:
34.80.Bm, 34.80.Ht, 34.80.Gs