Mt. Lee et al., The role played by electronic con-elation of target on the vibrational excitation cross sections of H-2 by electron impact, J MOL ST-TH, 541, 2001, pp. 51-57
We report a systematic study on the role played by electronic correlation o
f target on vibrational excitation processes of molecules by electron impac
t. More specifically, cross sections for vibrationally elastic and inelasti
c electron-Hz collisions are reported in the 1.5-40 eV range. In our study,
the electron-molecule interaction potential is derived using both the near
-Hartree-Fock and the configuration interaction target wavefunctions. The b
ody-frame vibrational close-coupling equations are solved using the method
of continued fractions (MCF). Our study has shown that the MCF is a very ef
ficient method for solving such scattering equations. In addition, the calc
ulated results have shown that the electronic correlation effects of target
significantly influence the calculated vibrational excitation cross sectio
ns at low incident energies and for the excitations leading to high-lying v
ibrational levels. Nevertheless, these effects are not relevant at higher i
ncident energies. (C) 2001 Elsevier Science B.V. All rights reserved.