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Structures and electronic states of endohedral dimetallofullerenes: M2@C80 (M = Sc, Y, La, Ce, Pr, Eu, Gd, Yb and Lu)

✍ Scribed by Kaoru Kobayashi; Shigeru Nagase


Book ID
107736710
Publisher
Elsevier Science
Year
1996
Tongue
English
Weight
441 KB
Volume
262
Category
Article
ISSN
0009-2614

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✍ Ramón Valencia; Antonio Rodríguez-Fortea; Anna Clotet; Coen de Graaf; Manuel N. 📂 Article 📅 2009 🏛 John Wiley and Sons 🌐 English ⚖ 622 KB

## Abstract An extensive study of the redox properties of metal nitride endohedral fullerenes (MNEFs) based on DFT computational calculations has been performed. The electronic structure of the singly oxidized and reduced MNEFs has been thoroughly analyzed and the first anodic and cathodic potentia