Effect of Fluorine Patterns on Electronic Transport in Fluorinated Graphene Full article
Journal |
Advanced Theory and Simulations
, E-ISSN: 2513-0390 |
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Output data | Year: 2020, Volume: 3, Number: 4, Article number : 1900199, Pages count : 6 DOI: 10.1002/adts.201900199 | ||||||||
Tags | electron transport; fluorinated graphene; graphene; molecular dynamics; molecular modeling | ||||||||
Authors |
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Affiliations |
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Funding (1)
1 | Russian Foundation for Basic Research | 19-32-50013 |
Abstract:
Within the framework of stochastic reactive molecular dynamics simulations a statistical method for generating fluorinated graphene structures with desirable fluorine distribution is developed. Electronic transport properties of fluorinated graphene in a wide range of functionalization degrees and system ordering are investigated. A strong correlation between irregularities in fluorine distribution and electronic properties is found. In particular, proposed consideration allows for the reproduction of both the experimentally observed electron–hole asymmetry in transport properties of fluorinated graphene and a recently revealed conductivity peak at 10% fluoride content. © 2020 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim
Cite:
Yamaletdinov R.D.
, Katkov V.L.
, Nikiforov Y.A.
, Okotrub A.V.
, Osipov V.A.
Effect of Fluorine Patterns on Electronic Transport in Fluorinated Graphene
Advanced Theory and Simulations. 2020. V.3. N4. 1900199 :1-6. DOI: 10.1002/adts.201900199 WOS Scopus РИНЦ
Effect of Fluorine Patterns on Electronic Transport in Fluorinated Graphene
Advanced Theory and Simulations. 2020. V.3. N4. 1900199 :1-6. DOI: 10.1002/adts.201900199 WOS Scopus РИНЦ
Files:
Full text from publisher
Dates:
Submitted: | Oct 8, 2019 |
Accepted: | Jan 2, 2020 |
Published online: | Feb 18, 2020 |
Published print: | Apr 1, 2020 |
Identifiers:
Web of science | WOS:000515277700001 |
Scopus | 2-s2.0-85079866370 |
Elibrary | 43242650 |
Chemical Abstracts | 2020:945070 |
OpenAlex | W3007579768 |