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- Title
Structure and stability of AgXe<sub>n</sub><sup>Z</sup>( ${\sf n=1}$–3, ${\sf Z=-1}$, 0, +1) clusters. Theoretical insights.
- Authors
Li, X.; Cao, X.; Jiang, J. H.; Zhao, Y. F.
- Abstract
The structure and stability of AgXenZ(n=1–3, Z=-1, 0, +1) cluster series at CCSD(T) theoretical level have been investigated. It is shown that the cations are more stable and have more compact geometries than the anions and neutrals. The role of the interaction was explained using the natural bond orbital (NBO) analysis.
- Subjects
GEOMETRIC analysis; ANIONS; LIGANDS (Chemistry); CHEMICAL bonds; CATIONS
- Publication
European Physical Journal D (EPJ D), 2010, Vol 55, Issue 1, p87
- ISSN
1434-6060
- Publication type
Article
- DOI
10.1140/epjd/e2009-00214-6