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We present a theoretical investigation on electron scattering by benzene (C 6 H 6 ) in the intermediate-energy range. Calculated elastic differential, integral, and momentum-transfer as well as total (elastic+inelastic) and total absorption cross sections are reported for impact energies ranging from 20 to 500eV. A complex optical potential is used to represent the electron–molecule...
We propose a practical computational scheme to obtain temperature dependence of dissociative electron attachment cross sections to polyatomic molecules within a local complex potential theory formalism. First we perform quantum path-integral molecular dynamics simulations on the potential energy surface for the neutral molecule in order to sample initial nuclear configurations as well as momenta....
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