Email this article On the Thermal Stability of Some Quasi-Fullerenes
- Authors: Podlivaev A.I.1,2, Openov L.A.1
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Affiliations:
- National Research Nuclear University MIPhI
- Research Institute for Problems in Development of Scientific and Educational Potential of Youth
- Issue: Vol 61, No 3 (2019)
- Pages: 474-479
- Section: Fullerenes
- URL: https://bakhtiniada.ru/1063-7834/article/view/205111
- DOI: https://doi.org/10.1134/S1063783419030260
- ID: 205111
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Abstract
The thermal stability of recently predicted quasi-fullerenes С20, С42, С48, and С60 is studied by the method of molecular dynamics. The routes of their decomposition and the temperature dependences of their lifetimes are determined. The activation energy and frequency factor values that appear in the Arrhenius law are found. New isomers are detected.
About the authors
A. I. Podlivaev
National Research Nuclear University MIPhI; Research Institute for Problems in Development of Scientific and Educational Potential of Youth
Author for correspondence.
Email: AIPodlivayev@mephi.ru
Russian Federation, Moscow; Moscow
L. A. Openov
National Research Nuclear University MIPhI
Email: AIPodlivayev@mephi.ru
Russian Federation, Moscow
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