Pg. Burke et al., ELECTRON-IMPACT EXCITATION OF COMPLEX ATOMS AND IONS, Journal of physics. B, Atomic molecular and optical physics, 27(21), 1994, pp. 5341-5373
A new R-matrix approach for calculating cross sections and rate coeffi
cients for electron-impact excitation of complex atoms and ions is des
cribed. This approach, based on an expansion of the total wavefunction
in target configurations rather than in individual target states and
taking advantage of the special status of the scattered electron in th
e collisional wavefunction, enables the angular integrals to be perfor
med very much more efficiently than hitherto. It also enables electron
correlation effects in the target and in the electron-target collisio
n complex to be treated consistently, eliminating pseudo-resonances wh
ich have caused serious difficulties in some earlier work. A major new
program package RMATRX II has been written that implements this appro
ach and, as an example, electron-impact excitation of Fe2+ is consider
ed where the four target configurations 3d(6), 3d(5)4s, 3d(5)4p and 3d
(5)4d are retained in the expansion of the total wavefunction. RMATRX
II is compared with the standard R-matrix program package and is found
to be much more efficient showing that accurate electron scattering c
alculations involving complex targets, such as the astrophysically imp
ortant low ionization stages of iron-peak elements are now possible.