Theoretical Electron Affinities for Some of the Alkali and Alkaline-Earth Elements
- 5 February 1968
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review B
- Vol. 166 (1) , 70-74
- https://doi.org/10.1103/physrev.166.70
Abstract
The correlation energies for the negative ions , , and have been calculated by the method of superposition of configurations. Comparisons with Hartree-Fock calculations of the neutral species yield electron affinities of 0.62, 0.54, and 0.47 eV, respectively. A study of the computed ionization potentials of the neighboring isoelectronic atoms and ions suggests a maximum uncertainty of 0.1 eV. Similar calculations of the states of and indicate that they are metastable, with electron affinities, relative to the state of the neutral atom, of 0.24 and 0.32 eV, respectively.
Keywords
This publication has 22 references indexed in Scilit:
- Theoretical Multiplet Strengths for Mg I, Al II, and Si IIIThe Journal of Chemical Physics, 1967
- Superposition of Configurations and Atomic Oscillator Strengths—Carbon i and iiPhysical Review B, 1967
- An experimental estimate of the electron affinity of lithiumPhysics Letters, 1966
- On the existence of negative beryllium and magnesium ionsPhysics Letters, 1966
- Correlation Effects in Complex Spectra. I. Term Energies for the Magnesium Isoelectronic SequenceThe Journal of Chemical Physics, 1966
- Pseudonatural Orbitals as a Basis for the Superposition of Configurations. I. He2+The Journal of Chemical Physics, 1966
- Many-Body Perturbation Theory Applied to Open-Shell AtomsPhysical Review B, 1966
- Theoretical Oscillator Strengths for Some Transitions of Astrophysical InterestThe Astrophysical Journal, 1966
- Many-Electron Theory of Atoms and Molecules. I. Shells, Electron Pairs vs Many-Electron CorrelationsThe Journal of Chemical Physics, 1962
- Natural Orbitals in the Quantum Theory of Two-Electron SystemsPhysical Review B, 1956