[As@Ni12@As20]3- and [Sn@Cu12@Sn20]12- clusters. Related structures with different construction philosophy

dc.contributor.author	MacLeod Carey D.
dc.contributor.author	Morales-Verdejo C.
dc.contributor.author	Muñoz-Castro A.
dc.date.accessioned	2020-09-02T22:21:54Z
dc.date.available	2020-09-02T22:21:54Z
dc.date.issued	2015
dc.identifier	10.1016/j.cplett.2015.08.039
dc.identifier.citation	638, , 99-102
dc.identifier.issn	00092614
dc.identifier.uri	https://hdl.handle.net/20.500.12728/5146
dc.description	[Sn@Cu12@Sn20]12- and [As@Ni12@As20]3- structures display highly spherical shapes according to A@B12@A20. Their analysis denote similar features in the electronic structure construction, however the resulting charge distribution exhibits large differences accounting for the different electronic requirements of such concentric structures. This leads to different electronic distribution in the overall system, where the composition of relevant electronic shells and charge distribution in the whole cluster is an important point to take into account in addition to well developed electron count rules. © 2015 Elsevier B.V. All rights reserved.
dc.language.iso	en
dc.publisher	Elsevier B.V.
dc.title	[As@Ni12@As20]3- and [Sn@Cu12@Sn20]12- clusters. Related structures with different construction philosophy
dc.type	Article

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