Theoretical study of the satellite structure in the photoelectron spectra of neon and argon
- 14 November 1990
- journal article
- Published by IOP Publishing in Journal of Physics B: Atomic, Molecular and Optical Physics
- Vol. 23 (21) , 3777-3784
- https://doi.org/10.1088/0953-4075/23/21/014
Abstract
CI calculations are performed for the lowest satellite states in the valence and core photoelectron spectra of Ne and Ar, at various excitation levels, up to 4h-3p/4h-4p. Use of relaxed orbitals relative to the doubly ionized system gives significant improvement at the lowest excitation level, and is subsequently employed in all calculations. Good agreement is obtained both for the energies and intensities, although the latter appear generally underestimated. A better agreement is obtained by the use of the sudden approximation including a plane-wave description of the photoelectron. The spectroscopic factor of the 3p43d satellite in Ar is discussed, and available evidence is found to support the value measured by X-ray photoelectron spectroscopy.Keywords
This publication has 21 references indexed in Scilit:
- Theoretical study of the valence photoelectron spectrum of ozone: An analysis of correlation effects and configuration interaction (CI) model spacesThe Journal of Chemical Physics, 1988
- Accurate wavefunctions for2S and2P0states in Ar IIJournal of Physics B: Atomic and Molecular Physics, 1987
- Configuration interaction calculations of satellite structure in photoelectron spectra of H2OChemical Physics, 1982
- Satellite structure in atomic spectra. I. Theoretical framework and application to excited states of the singly ionised rare gasesJournal of Physics B: Atomic and Molecular Physics, 1982
- Perturbation theory for multiconfiguration reference statesChemical Physics Letters, 1978
- Theory of the neoncorrelation-peak intensitiesPhysical Review A, 1976
- Theoretical equations for photoionization cross sections of polyatomic molecules in plane-wave and orthogonalized plane-wave approximationsThe Journal of Chemical Physics, 1974
- Asymptotic Double-Photoexcitation Cross Sections of the Helium AtomPhysical Review A, 1970
- Theory of X-Ray SatellitesPhysical Review B, 1967
- Gaussian-Type Functions for Polyatomic Systems. IThe Journal of Chemical Physics, 1965