Topological Efficiency Approach to Fullerene Stability - Case Study with C50
- Authors: Ante Graovac1, Ali Reza Ashrafi2, Ottorino Ori3
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View Affiliations Hide Affiliations1 Faculty of Science, University of Split, Nikole Tesle 12, HR-21000 Split, Croatia 2 2Department of Pure Mathematics, Faculty of Mathematical Sciences, University of Kashan, Kashan 87317 – 51167, I. R. Iran 3 Actinium Chemical Research, Via Casilina 1626/A, 00133 Rome, Italy
- Source: Advances in Mathematical Chemistry and Applications: Volume 2 , pp 3-23
- Publication Date: July 2015
- Language: English
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An innovative theoretical mechanism leading to the classification of the stability of fullerene isomers is presented. This approach is based on the action of suitable topological potentials impacting on molecular stability, namely topological compactness and topological sphericality indexes, providing a fast and general ranking algorithm. Present results point out that electronic properties of sp2 carbon systems are deeply rooted in the topology of their atomic network.
Hardbound ISBN:
9781681080536
Ebook ISBN:
9781681080529
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