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arxiv: 1110.5729 · v1 · pith:W3FW6GVHnew · submitted 2011-10-26 · ⚛️ physics.chem-ph

Dissociative electron attachment and vibrational excitation of CF₃Cl: Effect of two vibrational modes revisited

classification ⚛️ physics.chem-ph
keywords excitationvibrationalattachmentdissociativeelectronsymmetricc-clcoordinate
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We present a study of dissociative electron attachment and vibrational excitation processes in electron collisions with the CF$_3$Cl molecule. The calculations are based on the two-dimensional nuclear dynamics including the C-Cl symmetric stretch coordinate and the CF$_3$ symmetric deformation (umbrella) coordinate. The complex potential energy surfaces are calculated using the ab initio R-matrix method. The results for dissociative attachment and vibrational excitation of the umbrella mode agree quite well with experiment while the cross section for excitation of the C-Cl symmetric stretch vibrations is about a factor of three low as compared to experimental data.

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