Time-dependent study of collinear H-+H2(v) collisions
2000
It
has recently been shown [A. K. Belyaev and A. S. Tiukanov, Chem. Phys. Lett., 1999, 302, 65] that the electron
detachment process occurring during the reactive or inelastic H− + H2
encounter preferentially takes place from the first
excited state of H3−. The present paper investigates the possibility of this process occurring at a relatively
low collision energy (Ecoll<2.5 eV) by tunnelling through that first excited electronic state. We use a
two-state coupled wavepacket approach restricted to the collinear geometry, where the detachment probability is
accounted for by a negative imaginary potential. The calculation is carried out using both the adiabatic representation
and a diabatic representation. It is shown that the tunnelling effects efficiently populate the electron detachment channel
even in energy
domains where the first
excited H3− state is energetically closed.
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