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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...

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Detaylı Bibliyografya
Asıl Yazarlar: Kraka, Elfi, Cremer, Dieter
Materyal Türü: Artigo
Dil:Inglês
Baskı/Yayın Bilgisi: Molecular Diversity Preservation International (MDPI) 2008
Konular:
Online Erişim:https://ncbi.nlm.nih.gov/pmc/articles/PMC2658775/
https://ncbi.nlm.nih.gov/pubmed/19325837
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/ijms9060926
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