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Ionization potentials and excitation energies of the alkali-metal atoms by the relativistic coupled-cluster method

✍ Scribed by Eliav, Ephraim; Kaldor, Uzi; Ishikawa, Yasuyuki

Book ID
121385017
Publisher
The American Physical Society
Year
1994
Tongue
English
Weight
440 KB
Volume
50
Category
Article
ISSN
1050-2947

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πŸ“œ SIMILAR VOLUMES

Direct calculation of vertical ionizatio
Direct calculation of vertical ionization potentials by the coupled-cluster method
✍ Stanislav Biskupička; V. Kvasnička; R. Klein πŸ“‚ Article πŸ“… 1990 πŸ› Elsevier Science 🌐 English βš– 303 KB

The coupled-cluster method in an open-shell version with non-Hen&an model interaction is applied for direct calculation of vertical ionization potentials of closed-shell molecular systems. The theory is illustrated by calculation of vertical ionization potentials of the water molecule. The calculate