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For the DWCNT (13, 0)@(22, 0), we have obtained the electronic structure. We have also studied the electronic structure of the CNTs which include the Fe atomic wire. At the stable geometry in which the Fe atoms form a straight wire, the Fe wire was found to be located on the wall. We have obtained a ferromagnetic alignment and a novel anti-ferromagnetic one in Fe magnetic configurations as low energy states. 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マルチウォール型カーボンナノチューブの欠陥とその動力学に関する理論的研究
https://doi.org/10.24517/00059828
https://doi.org/10.24517/000598286ddfdcbe-c8fe-4445-b8e2-b6113df96736
名前 / ファイル | ライセンス | アクション |
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Item type | 報告書 / Research Paper(1) | |||||
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公開日 | 2022-05-16 | |||||
タイトル | ||||||
タイトル | マルチウォール型カーボンナノチューブの欠陥とその動力学に関する理論的研究 | |||||
タイトル | ||||||
言語 | en | |||||
タイトル | Theoretical study on the defects and their dynamics in multi-wall carbon nanotube | |||||
言語 | ||||||
言語 | jpn | |||||