Study of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse-grained molecular dynamics
In this paper, modeling and simulation of nanofilled crosslinked rubber using beads spring model was reported, and the effects of the crosslinking density, the dispersibility of nanofiller and the strength of filler-polymer interactions on the reinforcement in an elongation simulation were discussed...
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| Format: | Article |
| Language: | Japanese |
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The Japan Society of Mechanical Engineers
2014-02-01
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| Series: | Nihon Kikai Gakkai ronbunshu |
| Subjects: | |
| Online Access: | https://www.jstage.jst.go.jp/article/transjsme/80/810/80_2014cm0032/_pdf/-char/en |
| _version_ | 1817970092225331200 |
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| author | Hiromasa YAGYU |
| author_facet | Hiromasa YAGYU |
| author_sort | Hiromasa YAGYU |
| collection | DOAJ |
| description | In this paper, modeling and simulation of nanofilled crosslinked rubber using beads spring model was reported, and the effects of the crosslinking density, the dispersibility of nanofiller and the strength of filler-polymer interactions on the reinforcement in an elongation simulation were discussed. The models were consisted two fillers, five polymer-chains, and crosslinkers with four types of filler-rubber interaction based on the Lennard-Jones potential. From the uniaxial elongation simulation, it was confirmed that the strength of interaction was affected to the stress. Furthermore, the dependency of the elongation stress and the mobility of polymer beads around filler on temperature was carried out, and it was found that the presence of low-mobility phase around filler by a strong interaction lead to the reinforcement of filled crosslinked rubber. |
| first_indexed | 2024-04-13T20:29:44Z |
| format | Article |
| id | doaj.art-bf40f0f4fc594b61acec64d4e3d1773b |
| institution | Directory Open Access Journal |
| issn | 2187-9761 |
| language | Japanese |
| last_indexed | 2024-04-13T20:29:44Z |
| publishDate | 2014-02-01 |
| publisher | The Japan Society of Mechanical Engineers |
| record_format | Article |
| series | Nihon Kikai Gakkai ronbunshu |
| spelling | doaj.art-bf40f0f4fc594b61acec64d4e3d1773b2022-12-22T02:31:12ZjpnThe Japan Society of Mechanical EngineersNihon Kikai Gakkai ronbunshu2187-97612014-02-0180810CM0032CM003210.1299/transjsme.2014cm0032transjsmeStudy of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse-grained molecular dynamicsHiromasa YAGYU0Kanto Gakuin Univ. Division of Mechanical EngineeringIn this paper, modeling and simulation of nanofilled crosslinked rubber using beads spring model was reported, and the effects of the crosslinking density, the dispersibility of nanofiller and the strength of filler-polymer interactions on the reinforcement in an elongation simulation were discussed. The models were consisted two fillers, five polymer-chains, and crosslinkers with four types of filler-rubber interaction based on the Lennard-Jones potential. From the uniaxial elongation simulation, it was confirmed that the strength of interaction was affected to the stress. Furthermore, the dependency of the elongation stress and the mobility of polymer beads around filler on temperature was carried out, and it was found that the presence of low-mobility phase around filler by a strong interaction lead to the reinforcement of filled crosslinked rubber.https://www.jstage.jst.go.jp/article/transjsme/80/810/80_2014cm0032/_pdf/-char/enhigh polymer materialsmolecular simulationcomposite materialmolecular dynamicsinterface |
| spellingShingle | Hiromasa YAGYU Study of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse-grained molecular dynamics Nihon Kikai Gakkai ronbunshu high polymer materials molecular simulation composite material molecular dynamics interface |
| title | Study of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse-grained molecular dynamics |
| title_full | Study of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse-grained molecular dynamics |
| title_fullStr | Study of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse-grained molecular dynamics |
| title_full_unstemmed | Study of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse-grained molecular dynamics |
| title_short | Study of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse-grained molecular dynamics |
| title_sort | study of interfacial effect on reinforcement of nanofilled crosslinked rubber using coarse grained molecular dynamics |
| topic | high polymer materials molecular simulation composite material molecular dynamics interface |
| url | https://www.jstage.jst.go.jp/article/transjsme/80/810/80_2014cm0032/_pdf/-char/en |
| work_keys_str_mv | AT hiromasayagyu studyofinterfacialeffectonreinforcementofnanofilledcrosslinkedrubberusingcoarsegrainedmoleculardynamics |