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Bonding in Mercury-Alkali Molecules: Orbital-driven van der Waals Complexes
The bonding situation in mercury-alkali diatomics HgA ((2)Σ(+)) (A = Li, Na, K, Rb) has been investigated employing the relativistic all-electron method Normalized Elimination of the Small Component (NESC), CCSD(T), and augmented VTZ basis sets. Although Hg,A interactions are typical of van der Waal...
| Autores principales: | , |
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| Formato: | Texto |
| Lenguaje: | English |
| Publicado: |
Molecular Diversity Preservation International (MDPI)
2008
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2658775/ https://www.ncbi.nlm.nih.gov/pubmed/19325837 http://dx.doi.org/10.3390/ijms9060926 |