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• W2263088586 endingPage "11102" @default.
• W2263088586 startingPage "11098" @default.
• W2263088586 abstract "Metal carbide compound containing highly charged C2q- (q = 5, 6) moiety is rather scarce. We show by means of density functional calculations that an unprecedented μ4-C26- anion can viably exist as an endohedral [Sc4C2]6+ cluster in the endofullerene Sc4C2@C80. The electronic structure, ionization energy, electron affinity, 13C NMR chemical shifts, vibrational frequencies, and electrochemical redox potentials of this unique endofullerene have been predicted to assist future experimental characterization." @default.
• W2263088586 created "2016-06-24" @default.
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• W2263088586 creator A5090543789 @default.
• W2263088586 date "2006-05-20" @default.
• W2263088586 modified "2023-09-27" @default.
• W2263088586 title "Unprecedented μ₄-C₂^6- Anion in Sc₄C₂@C₈₀" @default.
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• W2263088586 doi "https://doi.org/10.1021/jp0623995" @default.
• W2263088586 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/16771371" @default.
• W2263088586 hasPublicationYear "2006" @default.
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