Articles with "domain averaged" as a keyword



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Insights from domain-averaged Fermi hole (DAFH) analysis and multicenter bond indices into the nature of Be(0) bonding

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Published in 2017 at "Structural Chemistry"

DOI: 10.1007/s11224-017-0914-2

Abstract: SummaryThe nature of the bonding interactions in the recently synthesized first stable neutral complex of so-called zero-valent beryllium (i.e. formally Be(0)) is investigated using the analysis of domain-averaged Fermi holes (DAFHs) and of multicenter bond… read more here.

Keywords: analysis; domain averaged; bond indices; nature bonding ... See more keywords