Cargando…

The Uncertainty Propagation for Carbon Atomic Interactions in Graphene under Resonant Vibration Based on Stochastic Finite Element Model

Graphene is one of the most promising two-dimensional nanomaterials with broad applications in many fields. However, the variations and fluctuations in the material and geometrical properties are challenging issues that require more concern. In order to quantify uncertainty and analyze the impacts o...

Descripción completa

Detalles Bibliográficos
Autores principales: Shi, Jiajia, Chu, Liu, Ma, Chao, Braun, Robin
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9147503/
https://www.ncbi.nlm.nih.gov/pubmed/35629705
http://dx.doi.org/10.3390/ma15103679
_version_ 1784716823420207104
author Shi, Jiajia
Chu, Liu
Ma, Chao
Braun, Robin
author_facet Shi, Jiajia
Chu, Liu
Ma, Chao
Braun, Robin
author_sort Shi, Jiajia
collection PubMed
description Graphene is one of the most promising two-dimensional nanomaterials with broad applications in many fields. However, the variations and fluctuations in the material and geometrical properties are challenging issues that require more concern. In order to quantify uncertainty and analyze the impacts of uncertainty, a stochastic finite element model (SFEM) is proposed to propagate uncertainty for carbon atomic interactions under resonant vibration. Compared with the conventional truss or beam finite element models, both carbon atoms and carbon covalent bonds are considered by introducing plane elements. In addition, the determined values of the material and geometrical parameters are expanded into the related interval ranges with uniform probability density distributions. Based on the SFEM, the uncertainty propagation is performed by the Monte Carlo stochastic sampling process, and the resonant frequencies of graphene are provided by finite element computation. Furthermore, the correlation coefficients of characteristic parameters are computed based on the database of SFEM. The vibration modes of graphene with the extreme geometrical values are also provided and analyzed. According to the computed results, the minimum and maximum values of the first resonant frequency are 0.2131 and 16.894 THz, respectively, and the variance is 2.5899 THz. The proposed SFEM is an effective method to propagate uncertainty and analyze the impacts of uncertainty in the carbon atomic interactions of graphene. The work in this paper provides an important supplement to the atomic interaction modeling in nanomaterials.
format Online
Article
Text
id pubmed-9147503
institution National Center for Biotechnology Information
language English
publishDate 2022
publisher MDPI
record_format MEDLINE/PubMed
spelling pubmed-91475032022-05-29 The Uncertainty Propagation for Carbon Atomic Interactions in Graphene under Resonant Vibration Based on Stochastic Finite Element Model Shi, Jiajia Chu, Liu Ma, Chao Braun, Robin Materials (Basel) Article Graphene is one of the most promising two-dimensional nanomaterials with broad applications in many fields. However, the variations and fluctuations in the material and geometrical properties are challenging issues that require more concern. In order to quantify uncertainty and analyze the impacts of uncertainty, a stochastic finite element model (SFEM) is proposed to propagate uncertainty for carbon atomic interactions under resonant vibration. Compared with the conventional truss or beam finite element models, both carbon atoms and carbon covalent bonds are considered by introducing plane elements. In addition, the determined values of the material and geometrical parameters are expanded into the related interval ranges with uniform probability density distributions. Based on the SFEM, the uncertainty propagation is performed by the Monte Carlo stochastic sampling process, and the resonant frequencies of graphene are provided by finite element computation. Furthermore, the correlation coefficients of characteristic parameters are computed based on the database of SFEM. The vibration modes of graphene with the extreme geometrical values are also provided and analyzed. According to the computed results, the minimum and maximum values of the first resonant frequency are 0.2131 and 16.894 THz, respectively, and the variance is 2.5899 THz. The proposed SFEM is an effective method to propagate uncertainty and analyze the impacts of uncertainty in the carbon atomic interactions of graphene. The work in this paper provides an important supplement to the atomic interaction modeling in nanomaterials. MDPI 2022-05-20 /pmc/articles/PMC9147503/ /pubmed/35629705 http://dx.doi.org/10.3390/ma15103679 Text en © 2022 by the authors. https://creativecommons.org/licenses/by/4.0/Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).
spellingShingle Article
Shi, Jiajia
Chu, Liu
Ma, Chao
Braun, Robin
The Uncertainty Propagation for Carbon Atomic Interactions in Graphene under Resonant Vibration Based on Stochastic Finite Element Model
title The Uncertainty Propagation for Carbon Atomic Interactions in Graphene under Resonant Vibration Based on Stochastic Finite Element Model
title_full The Uncertainty Propagation for Carbon Atomic Interactions in Graphene under Resonant Vibration Based on Stochastic Finite Element Model
title_fullStr The Uncertainty Propagation for Carbon Atomic Interactions in Graphene under Resonant Vibration Based on Stochastic Finite Element Model
title_full_unstemmed The Uncertainty Propagation for Carbon Atomic Interactions in Graphene under Resonant Vibration Based on Stochastic Finite Element Model
title_short The Uncertainty Propagation for Carbon Atomic Interactions in Graphene under Resonant Vibration Based on Stochastic Finite Element Model
title_sort uncertainty propagation for carbon atomic interactions in graphene under resonant vibration based on stochastic finite element model
topic Article
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9147503/
https://www.ncbi.nlm.nih.gov/pubmed/35629705
http://dx.doi.org/10.3390/ma15103679
work_keys_str_mv AT shijiajia theuncertaintypropagationforcarbonatomicinteractionsingrapheneunderresonantvibrationbasedonstochasticfiniteelementmodel
AT chuliu theuncertaintypropagationforcarbonatomicinteractionsingrapheneunderresonantvibrationbasedonstochasticfiniteelementmodel
AT machao theuncertaintypropagationforcarbonatomicinteractionsingrapheneunderresonantvibrationbasedonstochasticfiniteelementmodel
AT braunrobin theuncertaintypropagationforcarbonatomicinteractionsingrapheneunderresonantvibrationbasedonstochasticfiniteelementmodel
AT shijiajia uncertaintypropagationforcarbonatomicinteractionsingrapheneunderresonantvibrationbasedonstochasticfiniteelementmodel
AT chuliu uncertaintypropagationforcarbonatomicinteractionsingrapheneunderresonantvibrationbasedonstochasticfiniteelementmodel
AT machao uncertaintypropagationforcarbonatomicinteractionsingrapheneunderresonantvibrationbasedonstochasticfiniteelementmodel
AT braunrobin uncertaintypropagationforcarbonatomicinteractionsingrapheneunderresonantvibrationbasedonstochasticfiniteelementmodel