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Static structure of glass Agx(GeSe3)1-x based on ab initio molecular dynamics study
http://hdl.handle.net/2298/37305
http://hdl.handle.net/2298/3730580fea6ab-2d3a-49fb-b865-6ba5408c313b
名前 / ファイル | ライセンス | アクション |
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PR0014_081-088.pdf (201.5 kB)
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Item type | 紀要論文 / Departmental Bulletin Paper(1) | |||||
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公開日 | 2017-06-13 | |||||
タイトル | ||||||
言語 | en | |||||
タイトル | Static structure of glass Agx(GeSe3)1-x based on ab initio molecular dynamics study | |||||
言語 | ||||||
言語 | eng | |||||
資源タイプ | ||||||
資源タイプ | departmental bulletin paper | |||||
著者 |
Koura, Akihide
× Koura, Akihide× 下條, 冬樹 |
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内容記述 | ||||||
内容記述 | We have investigated the static structure of glass Agx(GeSe3)1-x (x=0.15, 0.33, and 0.50) based on ab initio molecular dynamics simulations. Even at the lower concentration x=0.15, Ag-Ag homopolar covalent bonds sometimes appear and short chain-type fragments are formed. The existence of phase separation may be suggested by the results of Mulliken population analysis and group analysis. | |||||
書誌情報 |
en : Physics Reports of Kumamoto University 巻 14, 号 2, p. 81-88, 発行年 2017 |
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ISSN | ||||||
収録物識別子 | 0303-4070 | |||||
NCID | ||||||
収録物識別子 | AA00774081 | |||||
著者版フラグ | ||||||
出版タイプ | VoR | |||||
日本十進分類法 | ||||||
主題 | 428.1 | |||||
出版者 | ||||||
言語 | ja | |||||
出版者 | 熊本大学 |