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Electronic and geometric properties of exohedral potassium-fullerenes

✍ Scribed by Franck Rabilloud

Publisher
Elsevier
Year
2011
Tongue
English
Weight
505 KB
Volume
964
Category
Article
ISSN
2210-271X

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✦ Synopsis

We investigate the structural and electronic properties of K n C 60 (n 6 12) clusters in the framework of density-functional theory. The behavior of the potassium atoms over the C 60 surface is analyzed. For K 12 C 60 , potassium atoms are found to form 4-atom islands on the surface. The charge transfer and the energetics are discussed in relation with available results.

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