Bound and continuum states of molecular anions C2H and C3N

Stephen Harrison (1) , Jonathan Tennyson (1)

1 Department of Physics and Astronomy [UCL London]

Recently a number of molecular anions, closed-shell linear carbon chains of the form C n H − and C n N −, have been detected in space. The molecules C 2 H − and C 3 N − are investigated by using the R-Matrix method to consider electron scattering from the corresponding neutral targets. Initial target calculations are conducted and refined in order to produce target state characteristics similar to the experimental data. A number of different scattering models are tested including static exchange and closecoupling models, and the use of Hartree-Fock or natural orbitals in the close-coupling calculations. The calculations concentrate on bound and resonances states for the anions as well as eigenphase sums, elastic cross-sections and electronic excitation crosssections for electron collisions with the neutral. It is found that electronic resonances are all too high in energy to be important for anion formation in the interstellar medium. However, C 3 N −, unlike C 2 H −, supports a number of very weakly bound excited states, which may well provide the route to electron attachment for this system.

Mots clés: Physical Sciences

Stephen Harrison, Jonathan Tennyson. Bound and continuum states of molecular anions C2H and C3N. Journal of Physics B: Atomic, Molecular and Optical Physics, 2011, 44 (4), pp.45206. ⟨10.1088/0953-4075/44/4/045206⟩. ⟨hal-00596622⟩