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Topological resonance energies of fullerenes and their molecular ions

✍ Scribed by Jun-ichi Aihara


Book ID
114141894
Publisher
Elsevier Science
Year
1994
Tongue
English
Weight
534 KB
Volume
311
Category
Article
ISSN
0166-1280

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The topological resonance energies (TRE) for various fullerene clusters ( C2a to C,) have been computed and based on this, stabilities of fttllerenes are discussed. Trend in stability predicted by the TRE model is compared with predictions from the conjugated circuit model as well as the MNDO and ab