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Fluorine patterning of graphene : Effects of fluorine content and temperature. / Yamaletdinov, Ruslan D.; Nikiforov, Yaroslav A.; Bulusheva, Lyubov G. et al.

In: Nanoscale, Vol. 13, No. 2, 14.01.2021, p. 1206-1212.

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Yamaletdinov RD, Nikiforov YA, Bulusheva LG, Okotrub AV. Fluorine patterning of graphene: Effects of fluorine content and temperature. Nanoscale. 2021 Jan 14;13(2):1206-1212. doi: 10.1039/d0nr06325h

Author

Yamaletdinov, Ruslan D. ; Nikiforov, Yaroslav A. ; Bulusheva, Lyubov G. et al. / Fluorine patterning of graphene : Effects of fluorine content and temperature. In: Nanoscale. 2021 ; Vol. 13, No. 2. pp. 1206-1212.

BibTeX

@article{4f5bbb43f7ec4e39b0de3cb0a8ce2fd8,
title = "Fluorine patterning of graphene: Effects of fluorine content and temperature",
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. This journal is ",
keywords = "ELECTRONIC-STRUCTURE, QUANTUM-CHEMISTRY, GRAPHITE",
author = "Yamaletdinov, {Ruslan D.} and Nikiforov, {Yaroslav A.} and Bulusheva, {Lyubov G.} and Okotrub, {Alexander V.}",
note = "Funding Information: The reported study was funded by RFBR, project number 19-32-60012. Publisher Copyright: {\textcopyright} The Royal Society of Chemistry. Copyright: Copyright 2021 Elsevier B.V., All rights reserved.",
year = "2021",
month = jan,
day = "14",
doi = "10.1039/d0nr06325h",
language = "English",
volume = "13",
pages = "1206--1212",
journal = "Nanoscale",
issn = "2040-3364",
publisher = "Royal Society of Chemistry",
number = "2",

}

RIS

TY - JOUR

T1 - Fluorine patterning of graphene

T2 - Effects of fluorine content and temperature

AU - Yamaletdinov, Ruslan D.

AU - Nikiforov, Yaroslav A.

AU - Bulusheva, Lyubov G.

AU - Okotrub, Alexander V.

N1 - Funding Information: The reported study was funded by RFBR, project number 19-32-60012. Publisher Copyright: © The Royal Society of Chemistry. Copyright: Copyright 2021 Elsevier B.V., All rights reserved.

PY - 2021/1/14

Y1 - 2021/1/14

N2 - 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. This journal is

AB - 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. This journal is

KW - ELECTRONIC-STRUCTURE

KW - QUANTUM-CHEMISTRY

KW - GRAPHITE

UR - http://www.scopus.com/inward/record.url?scp=85099779492&partnerID=8YFLogxK

U2 - 10.1039/d0nr06325h

DO - 10.1039/d0nr06325h

M3 - Article

C2 - 33404033

AN - SCOPUS:85099779492

VL - 13

SP - 1206

EP - 1212

JO - Nanoscale

JF - Nanoscale

SN - 2040-3364

IS - 2

ER -

ID: 27641688