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Exploring the effect of pendent side chain length on the structural and mechanical properties of hydrated perfluorosulfonic acid polymer membranes by molecular dynamics simulation
http://hdl.handle.net/2237/00028605
http://hdl.handle.net/2237/0002860503744494-7a4f-44f5-b77b-f3a66eab854e
名前 / ファイル | ライセンス | アクション |
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Item type | 学術雑誌論文 / Journal Article(1) | |||||
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公開日 | 2018-10-09 | |||||
タイトル | ||||||
タイトル | Exploring the effect of pendent side chain length on the structural and mechanical properties of hydrated perfluorosulfonic acid polymer membranes by molecular dynamics simulation | |||||
言語 | en | |||||
著者 |
Kuo, An-Tsung
× Kuo, An-Tsung× Takeuchi, Kotono× Tanaka, Atsushi× Urata, Shingo× Okazaki, Susumu× Shinoda, Wataru |
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アクセス権 | ||||||
アクセス権 | open access | |||||
アクセス権URI | http://purl.org/coar/access_right/c_abf2 | |||||
権利 | ||||||
言語 | en | |||||
権利情報 | © 2018. This manuscript version is made available under the CC-BY-NC-ND 4.0 license http://creativecommons.org/licenses/by-nc-nd/4.0/ | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Molecular dynamics simulation | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Perfluorosulfonic acid | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Side chain | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Morphology | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Mechanical deformation | |||||
抄録 | ||||||
内容記述 | The side chain (SC) length of perfluorosulfonic acid (PFSA) reportedly influences the proton conductivity and mechanical strength of the membranes in the application of proton exchange membrane. Here, we conducted a series of molecular dynamics simulations to explore the effect of SC length on the morphology and mechanical properties of the PFSA membrane. The results of these simulations pointed to the stronger aggregation of the aqueous domain in the longer SC membranes. This leads to the swollen network structure of the aqueous domains at high water contents, rather than the tortuous layer structure observed in the shorter SC membrane. Furthermore, the mechanical simulation found that the longer SC membranes possessed lower and higher mechanical strengths than the shorter SC membranes at lower and higher water contents, respectively, resulting from the lower ionic strength and larger polymer domains. These findings will be useful for designing new materials for fuel cell applications. | |||||
言語 | en | |||||
内容記述タイプ | Abstract | |||||
内容記述 | ||||||
内容記述 | ファイル公開:2020-06-20 | |||||
言語 | ja | |||||
内容記述タイプ | Other | |||||
出版者 | ||||||
言語 | en | |||||
出版者 | Elsevier | |||||
言語 | ||||||
言語 | eng | |||||
資源タイプ | ||||||
資源タイプresource | http://purl.org/coar/resource_type/c_6501 | |||||
タイプ | journal article | |||||
出版タイプ | ||||||
出版タイプ | AM | |||||
出版タイプResource | http://purl.org/coar/version/c_ab4af688f83e57aa | |||||
DOI | ||||||
関連タイプ | isVersionOf | |||||
識別子タイプ | DOI | |||||
関連識別子 | https://doi.org/10.1016/j.polymer.2018.05.033 | |||||
ISSN(print) | ||||||
収録物識別子タイプ | PISSN | |||||
収録物識別子 | 0032-3861 | |||||
書誌情報 |
en : Polymer 巻 146, p. 53-62, 発行日 2018-06-20 |
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著者版フラグ | ||||||
値 | author |