Near L -edge Single and Multiple Photoionization of Triply Charged Iron Ions

Relative cross sections for m-fold photoionization (m=1,K,5) of Fe3+ by single-photon absorption weremeasured employing the photon-ion merged-beams setup PIPE at the PETRA III synchrotron light source operatedat DESY in Hamburg, Germany. The photon energies used spanned the range of 680–950 eV, covering both thephotoexcitation resonances from the 2p and 2s shells, as well as the direct ionization from both shells.Multiconfiguration Dirac–Hartree–Fock (MCDHF) calculations were performed to simulate the totalphotoexcitation spectra. Good agreement was found with the experimental results. These computations helpedto assign several strong resonance features to specific transitions. We also carried out Hartree–Fock calculationswith relativistic extensions taking into account both photoexcitation and photoionization. Furthermore, weperformed extensive MCDHF calculations of the Auger cascades that result when an electron is removed from the2p and 2s shells of Fe3+. Our theoretically predicted charge-state fractions are in good agreement with theexperimental results, representing a substantial improvement over previous theoretical calculations. The mainreason for the disagreement with the previous calculations is their lack of inclusion of slow Auger decays of severalconfigurations that can only proceed when accompanied by de-excitation of two electrons. In such cases, thisadditional shake-down transition of a (sub)valence electron is required to gain the necessary energy for the releaseof the Auger electron