Author/Authors :
Vukicevic، نويسنده , , Damir and Cataldo، نويسنده , , Franco and Ori، نويسنده , , Ottorino and Graovac، نويسنده , , Ante، نويسنده ,
Abstract :
A novel method for the topological determination of the relative stability of the C66 isomers is proposed in this Letter. Among 4478 distinct isomers of the C66 fullerene, the joint actions of topological compactness (Wiener index) and topological efficiency index correctly sieve the C66–C2v molecule detected in Sc2@C66 endoclusters. This elegant and fast computational method is suggested to be applicable to any Cn fullerene or graphenic lattice.
