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Climbing end image algorithm to locate transition states
http://hdl.handle.net/10466/00017403
http://hdl.handle.net/10466/00017403705f32ed-faae-426f-aa44-90fcc65e8639
名前 / ファイル | ライセンス | アクション |
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2021000062 (699.3 kB)
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Item type | 学術雑誌論文 / Journal Article(1) | |||||
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公開日 | 2021-06-09 | |||||
タイトル | ||||||
タイトル | Climbing end image algorithm to locate transition states | |||||
言語 | ||||||
言語 | eng | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Climbing end image algorithm | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Nudged elastic band | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Transition state optimization | |||||
キーワード | ||||||
主題Scheme | Other | |||||
主題 | Witting reaction | |||||
資源タイプ | ||||||
資源タイプ識別子 | http://purl.org/coar/resource_type/c_6501 | |||||
資源タイプ | journal article | |||||
著者 |
Asada, Toshio
× Asada, Toshio× Sawada, Nozomi× Haruta, Mamoru× Koseki, Shiro |
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著者別名 | ||||||
姓名 | 麻田, 俊雄 | |||||
著者別名 | ||||||
姓名 | 小関, 史朗 | |||||
引用 | ||||||
内容記述タイプ | Other | |||||
内容記述 | Chemical Physics Letters. 2021, 775, P.138658 | |||||
書誌情報 |
Chemical Physics Letters 巻 775, p. 138658, 発行日 2021-07-16 |
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ISSN | ||||||
収録物識別子タイプ | ISSN | |||||
収録物識別子 | 0009-2614 | |||||
DOI_url | ||||||
関連タイプ | isVersionOf | |||||
識別子タイプ | DOI | |||||
関連識別子 | https://doi.org/10.1016/j.cplett.2021.138658 | |||||
権利 | ||||||
権利情報 | © 2021. This manuscript version is made available under the CC-BY-NC-ND 4.0 license http://creativecommons.org/licenses/by-nc-nd/4.0/ | |||||
フォーマット | ||||||
内容記述タイプ | Other | |||||
内容記述 | application/pdf | |||||
著者版フラグ | ||||||
出版タイプ | AM | |||||
出版タイプResource | http://purl.org/coar/version/c_ab4af688f83e57aa | |||||
出版者 | ||||||
出版者 | Elsevier |