Model of Interaction of Fullerene С60 with Epitaxial Graphene
- Авторлар: Rekhviashvili S.S.1, Bukhurova M.M.1
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Мекемелер:
- Institute of Applied Mathematics and Automatization, Russian Academy of Sciences, Kabardino-Balkarian Scientific Center
- Шығарылым: Том 92, № 10 (2018)
- Беттер: 1935-1939
- Бөлім: Structure of Matter and Quantum Chemistry
- URL: https://bakhtiniada.ru/0036-0244/article/view/170158
- DOI: https://doi.org/10.1134/S0036024418100266
- ID: 170158
Дәйексөз келтіру
Аннотация
Equations for the potential and force of interaction of fullerene C60 with epitaxial graphene adsorbed on a thick substrate were derived using the Lennard-Jones pair potential. The nature of this interaction is mainly determined by the fullerene–graphene system, while the substrate makes a critical contribution to the attraction force at long distances between fullerene and graphene. A numerical simulation of the incidence of the fullerene molecule on epitaxial graphene was performed. The molecule oscillates near the surface; the character of this motion depends on the initial conditions and interaction parameters. An equation for the specific adhesion energy of graphene was obtained.
Негізгі сөздер
Авторлар туралы
S. Rekhviashvili
Institute of Applied Mathematics and Automatization, Russian Academy of Sciences,Kabardino-Balkarian Scientific Center
Хат алмасуға жауапты Автор.
Email: rsergo@mail.ru
Ресей, Nalchik, 360000
M. Bukhurova
Institute of Applied Mathematics and Automatization, Russian Academy of Sciences,Kabardino-Balkarian Scientific Center
Хат алмасуға жауапты Автор.
Email: mareta.bukhurova@mail.ru
Ресей, Nalchik, 360000
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