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C60 molecules show atom-like states: Characterization

✍ Scribed by Katerina Busuttil

Book ID
104418741
Publisher
Elsevier Science
Year
2008
Tongue
English
Weight
88 KB
Volume
11
Category
Article
ISSN
1369-7021

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The electronic states and the bond lengths of the truncated icosahedral C,, molecule have been calculated by the Htickel and Coulson-Golebiewski self-consistent Htickel methods. C,, has a stable closed shell with a rather big energy gap ( = 0.847 p) between the HOMO and the LUMO. We have obtained tw