Ea. Garcia et al., MODEL CALCULATION OF THE CHARGE-TRANSFER IN LOW-ENERGY HE+ SCATTERINGFROM METALLIC SURFACES, Physical review. B, Condensed matter, 52(23), 1995, pp. 16924-16932
Charge-transfer mechanisms in low-energy helium-scattering spectroscop
y are analyzed by using an Anderson-like description of the time-depen
dent collisional process, which allows us to include several electroni
c bands of extended and localized nature in the solid. The Hamiltonian
parameters are obtained from a Hartree-Fock self-consistent-field cal
culation of the He-target atom dimeric system. We examine in particula
r cases such as Ca and Ga linear chain substrates. We found that at ve
locities large enough, the localized state in the solid contributes to
the He+ neutralization, showing the characteristic oscillatory behavi
or of the nonadiabatic charge exchange between localized states, in ag
reement with other calculations. In the range of low velocities we fou
nd that if the hybridization between the He orbital and the localized
states in the solid is able to produce the formation of an antibonding
state having a predominant weight of the He-1s orbital, this' promote
s the charge exchange between the Helium and the extended bandstates o
f the solid.