Configuration interaction effects in low-energy electron collisions with Fe II

Autor: Catherine Ramsbottom, Margaret Scott, V.M. Burke, C.J. Noble, Philip G. Burke
Rok vydání: 2004
Předmět:
Zdroj: Journal of Physics B: Atomic, Molecular and Optical Physics. 37:3609-3631
ISSN: 1361-6455
0953-4075
Popis: Partial wave collision strengths are presented for low-energy electron-impact transitions in Fe II between the 3d 6 4 sa 6 D e ground state and the 3d 7 a 4 F e , 3d 6 4s a 4 D e and 3d 7 a 4 P e low-lying excited states. The collision strengths are calculated in LS coupling using a new Fortran 95 R-matrix program including all terms of the 3d 6 4s, 3d 7 , 3d 6 4p, 3d 5 4s 2 and 3d 5 4s4p configurations in the close coupling expansion of the collision wavefunction. Special emphasis is given to the inclusion of configuration interaction (CI) effects both in the target and in the collision wavefunctions. In both cases series of calculations are carried out where additional CI terms are included systematically. It is found that in order to obtain close to converged low-energy partial wave collision strengths two-electron excitations from the 3p shell to the 3d shell as well as pseudo s and d orbitals must be included in the CI expansions. Also resonance effects in low-energy partial wave collision strengths are found to depend sensitively on the representation of the d orbitals in the CI expansion of the collision wavefunction. Finally, CI models for both the target and collision wavefunctions are defined which can be used in proposed calculations to obtain accurate total collision strengths and effective collision strengths for transitions between LS-coupled terms and between fine-structure levels of Fe II.
Databáze: OpenAIRE