Heteromolecules Based on Diamondene–Graphene Fragments Modified with Metals (Fe, Ni, Co)
- Авторы: Chekulaev M.S.1, Yastrebov S.G.1
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Учреждения:
- Ioffe Physical Technical Institute, Russian Academy of Sciences
- Выпуск: Том 45, № 12 (2019)
- Страницы: 1249-1251
- Раздел: Article
- URL: https://bakhtiniada.ru/1063-7850/article/view/208514
- DOI: https://doi.org/10.1134/S1063785019120186
- ID: 208514
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Аннотация
We describe a model of a stable, metal-modified heteromolecule based on a hybrid of diamondene and graphene containing hydrogen atoms for the stabilization of sp3 bonds. Hydrogen atoms were replaced by atoms of carbide-forming metals (Fe, Co, Ni). After the replacement of H atoms by Fe, Co, and Ni atoms in the initial heteromolecule and optimization of its geometry, it turned out that the resulting structure was stable. This result leads to the conclusion that metal atoms can be useful in the synthesis of diamondene and diamond.
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Об авторах
M. Chekulaev
Ioffe Physical Technical Institute, Russian Academy of Sciences
Автор, ответственный за переписку.
Email: mchs89@mail.ioffe.ru
Россия, St. Petersburg, 194021
S. Yastrebov
Ioffe Physical Technical Institute, Russian Academy of Sciences
Email: mchs89@mail.ioffe.ru
Россия, St. Petersburg, 194021
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