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The ways to form midi-fullerens structure exemplified by С22, С24 and С26 isomers

Authors :
Matvienko Aleksandra
Source :
St. Petersburg Polytechnical University Journal: Physics and Mathematics, Vol 16, Iss 1 (2023)
Publication Year :
2023
Publisher :
Peter the Great St.Petersburg Polytechnic University, 2023.

Abstract

In this paper, the possible ways of forming the midi-fullerene isomers, namely C22, C24 and C26, have been systematized. Three simplest mechanisms for their synthesizing are known. They are the fusion of carbon cupolas having the same symmetry; the fusion of fullerenes having compatible symmetry; embedding carbon dimers into initial fullerenes. The structures with minimal energy were formed through the use of the third mechanism retaining the topological three-fold symmetry. The symmetry order of studied fullerenes changed from the third to the sixth. The geometric modeling carried out in conjunction with the analysis of structures’ formation energies gives researchers a clear idea of the structure of the resulting fullerenes.

Details

Language :
English, Russian
ISSN :
24057223
Volume :
16
Issue :
1
Database :
Directory of Open Access Journals
Journal :
St. Petersburg Polytechnical University Journal: Physics and Mathematics
Publication Type :
Academic Journal
Accession number :
edsdoj.562e5aaf52c4e1e817182de46c13303
Document Type :
article
Full Text :
https://doi.org/10.18721/JPM.16110