Fluorine Patterning of Graphene: Effects of Fluorine Content and Temperature Full article
Journal |
Nanoscale
ISSN: 2040-3364 , E-ISSN: 2040-3372 |
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Output data | Year: 2021, Volume: 13, Number: 2, Pages: 1206-1212 Pages count : 7 DOI: 10.1039/d0nr06325h | ||||||
Tags | ELECTRONIC-STRUCTURE; QUANTUM-CHEMISTRY; GRAPHITE | ||||||
Authors |
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Affiliations |
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Funding (1)
1 | Russian Foundation for Basic Research | 19-32-60012 |
Abstract:
In this paper we present a successful approach for the generation of partially fluorinated graphene structures. A computationally simple model optimized on a large density functional theory dataset quickly and precisely predicts experimentally observed structures. From the analysis of the structural diversity of fluorinated graphene in a wide range of synthesis temperatures, the general structural patterns are identified and the conditions for their achievement are determined. In addition, to facilitate further studies of fluorinated graphene, we present a ready-to-use GenCF code that implements the described structure generator.
Cite:
Yamaletdinov R.D.
, Nikiforov Y.A.
, Bulusheva L.G.
, Okotrub A.V.
Fluorine Patterning of Graphene: Effects of Fluorine Content and Temperature
Nanoscale. 2021. V.13. N2. P.1206-1212. DOI: 10.1039/d0nr06325h WOS Scopus РИНЦ
Fluorine Patterning of Graphene: Effects of Fluorine Content and Temperature
Nanoscale. 2021. V.13. N2. P.1206-1212. DOI: 10.1039/d0nr06325h WOS Scopus РИНЦ
Files:
Full text from publisher
Dates:
Submitted: | Sep 1, 2020 |
Accepted: | Nov 27, 2020 |
Published online: | Dec 10, 2020 |
Published print: | Jan 14, 2021 |
Identifiers:
Web of science | WOS:000610368100063 |
Scopus | 2-s2.0-85099779492 |
Elibrary | 44991409 |
Chemical Abstracts | 2020:2543831 |
Chemical Abstracts (print) | 174:589358 |
PMID | 33404033 |
OpenAlex | W3111629839 |