Multiconfiguration calculation of the oxygenP3ground-state fine structure
- 1 May 1975
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review A
- Vol. 11 (5), 1498-1500
- https://doi.org/10.1103/physreva.11.1498
Abstract
The fine structure of the oxygen ground state is computed using a rather simple multiconfiguration wave function. The approach is similar to that used in previously reported fine-structure calculations for the lowest nitrogen and states, and similar results are obtained, accounting for about 80% of the difference between the Hartree-Fock result for the spin-orbit coupling parameter and the value indicated by experiment. The contribution due to spin-spin coupling is also considered.
Keywords
This publication has 3 references indexed in Scilit:
- Hartree-Fock Wavefunctions of Nominal Accuracy for He through Rb+ Calculated by the Expansion MethodThe Journal of Chemical Physics, 1972
- Pauli Approximation in Many-Electron AtomsPhysical Review A, 1972
- Multi-Configuration Self-Consistent-Field TheoryProgress of Theoretical Physics Supplement, 1967