Influence of caged noble-gas atom on the superatomic and valence states of C60−

Using high-level ab initio coupled cluster methods, we have conducted a detailed study of two endofullerene anions, HeC−60 and Ne@C−60. The main focus was on elucidating the effect of the noble-gas atom on the energy and electronic structure of the stable anion states of the parent C−60. Our study r...

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Bibliographic Details
Main Authors: Gromov, Evgeniy (Author) , Klaiman, Shachar (Author) , Cederbaum, Lorenz S. (Author)
Format: Article (Journal)
Language:English
Published: 09 Jul 2015
In: Molecular physics
Year: 2015, Volume: 113, Issue: 19-20, Pages: 2964-2969
ISSN:1362-3028
DOI:10.1080/00268976.2015.1060367
Online Access:Verlag, lizenzpflichtig, Volltext: https://doi.org/10.1080/00268976.2015.1060367
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Author Notes:Evgeniy V. Gromov, Shachar Klaiman and Lorenz S. Cederbaum
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How many bound valence states does the C60− anion have? by Gromov, Evgeniy (Author) , Klaiman, Shachar (Author) , Cederbaum, Lorenz S. (Author) ,


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