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The ground-state potential energy function of a beryllium dimer determined using the single-reference coupled-cluster approach

✍ Scribed by Koput, Jacek


Book ID
111653417
Publisher
Royal Society of Chemistry
Year
2011
Tongue
English
Weight
807 KB
Volume
13
Category
Article
ISSN
1463-9076

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## Abstract The dissociation energy, equilibrium internuclear distance, and spectroscopic constants for the ^1^Ξ£ ground state of the Yb~2~ molecule are calculated. The relativistic effects are introduced through generalized relativistic effective core potentials with very high precision. The scalar