P. Decleva et al., MULTICHANNEL CONTINUUM STATES BY A LEAST-SQUARES APPROACH IN A SPLINEBASIS - APPLICATION TO HE-PHOTOIONIZATION AND H-PHOTOIONIZATION, Journal of physics. B, Atomic molecular and optical physics, 27(20), 1994, pp. 4867-4889
A recently proposed algorithm for the determination of the continuum w
avefunction employing a B-spline basis set expansion and a least-squar
es approach is extended to a full multichannel formulation employing a
general close coupling expansion of the continuum wavefunction. Photo
ionization of the He atom up to the n=4 threshold and H- up to the n=3
threshold are described with a pure close coupling wavefunction (16 a
nd 9 channels respectively), and an accurate full CI expansion for the
ground state. Excellent agreement with previous accurate calculations
is obtained for total and partial cross sections, resonance parameter
s and angular distributions. For He a nine-channel wavefunction allows
photoionization to be described up to 2 keV. Modification of the boun
dary conditions to describe long Rydberg series is successfully tested
. The proposed algorithm appears to be a general and flexible approach
for the description of multichannel continuum wavefunctions by basis
set expansion.