Enviar artigo por via de e-mail Thermal annealing of Stone–Wales defects in fullerenes and nanotubes
- Autores: Podlivaev A.I.1,2, Openov L.A.1
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Afiliações:
- National Research Nuclear University “MEPhI,”
- Research Institute of Problems in the Development of Scientific and Educational Potential of Young People
- Edição: Volume 60, Nº 1 (2018)
- Páginas: 162-166
- Seção: Low-Dimensional Systems
- URL: https://journals.rcsi.science/1063-7834/article/view/201944
- DOI: https://doi.org/10.1134/S1063783418010183
- ID: 201944
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Resumo
The thermally activated annealing of topological Stone–Wales defects in carbon fullerenes and nanotubes is studied via molecular dynamics. The temperature dependences of characteristic times are shown to obey the Arrhenius law. The values of the relevant activation energies and frequency factors are found. The results are compared with the simulated potential energy surface data.
Sobre autores
A. Podlivaev
National Research Nuclear University “MEPhI,”; Research Institute of Problems in the Development of Scientific and Educational Potential of Young People
Autor responsável pela correspondência
Email: AIPodlivayev@mephi.ru
Rússia, Moscow; Moscow
L. Openov
National Research Nuclear University “MEPhI,”
Email: AIPodlivayev@mephi.ru
Rússia, Moscow
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