Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms
We investigate the spin polarization of a non magnetic material, e.g., a carbon material made from ten C atoms forming a hexagonal structure with total spin S = 0, induced by a ferromagnetic material, e.g., two Fe atoms with a total spin S = 4. Based on the density functional theory, we calculate th...
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American Scientific Publishers
2014
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| オンライン･アクセス: | http://psasir.upm.edu.my/id/eprint/36980/1/Density%20functional%20study%20of%20spin%20polarization%20on%20a%20carbon%20material%20with%20a%20hexagonal%20structure%20induced%20by%20iron%20atoms.pdf http://psasir.upm.edu.my/id/eprint/36980/ http://www.ingentaconnect.com/content/asp/jctn/2014/00000011/00000001/art00009?token=003f1b703b719b6f98c39412f415d766b2524702e7b457a3863382530332948 |
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my.upm.eprints.369802015-10-06T04:09:22Z http://psasir.upm.edu.my/id/eprint/36980/ Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms Muhida, Rifki Rahman, Md. Mahmudur Chowdhury, Md. Sazzad Hossien Setiyanto, Henry Zainuddin, Hishamuddin Zakaria, Azmi Kasai, Hideaki We investigate the spin polarization of a non magnetic material, e.g., a carbon material made from ten C atoms forming a hexagonal structure with total spin S = 0, induced by a ferromagnetic material, e.g., two Fe atoms with a total spin S = 4. Based on the density functional theory, we calculate the total spin density of the system. Our preliminary results show that the total spin for the ten C atoms changes from S = 0 to S = 4, while the total spin of the two Fe atoms changes from S = 4 to S =0. These results seem to indicate that there is a promising possibility to induce spin polarization on a carbon material by Fe atoms. American Scientific Publishers 2014-01 Article PeerReviewed application/pdf en http://psasir.upm.edu.my/id/eprint/36980/1/Density%20functional%20study%20of%20spin%20polarization%20on%20a%20carbon%20material%20with%20a%20hexagonal%20structure%20induced%20by%20iron%20atoms.pdf Muhida, Rifki and Rahman, Md. Mahmudur and Chowdhury, Md. Sazzad Hossien and Setiyanto, Henry and Zainuddin, Hishamuddin and Zakaria, Azmi and Kasai, Hideaki (2014) Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms. Journal of Computational and Theoretical Nanoscience, 11 (1). pp. 58-61. ISSN 1546-1955; ESSN: 1546-1963 http://www.ingentaconnect.com/content/asp/jctn/2014/00000011/00000001/art00009?token=003f1b703b719b6f98c39412f415d766b2524702e7b457a3863382530332948 10.1166/jctn.2014.3317 |
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We investigate the spin polarization of a non magnetic material, e.g., a carbon material made from ten C atoms forming a hexagonal structure with total spin S = 0, induced by a ferromagnetic material, e.g., two Fe atoms with a total spin S = 4. Based on the density functional theory, we calculate the total spin density of the system. Our preliminary results show that the total spin for the ten C atoms changes from S = 0 to S = 4, while the total spin of the two Fe atoms changes from S = 4 to S =0. These results seem to indicate that there is a promising possibility to induce spin polarization on a carbon material by Fe atoms. |
| format |
Article |
| author |
Muhida, Rifki Rahman, Md. Mahmudur Chowdhury, Md. Sazzad Hossien Setiyanto, Henry Zainuddin, Hishamuddin Zakaria, Azmi Kasai, Hideaki |
| spellingShingle |
Muhida, Rifki Rahman, Md. Mahmudur Chowdhury, Md. Sazzad Hossien Setiyanto, Henry Zainuddin, Hishamuddin Zakaria, Azmi Kasai, Hideaki Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms |
| author_facet |
Muhida, Rifki Rahman, Md. Mahmudur Chowdhury, Md. Sazzad Hossien Setiyanto, Henry Zainuddin, Hishamuddin Zakaria, Azmi Kasai, Hideaki |
| author_sort |
Muhida, Rifki |
| title |
Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms |
| title_short |
Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms |
| title_full |
Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms |
| title_fullStr |
Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms |
| title_full_unstemmed |
Density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms |
| title_sort |
density functional study of spin polarization on a carbon material with a hexagonal structure induced by iron atoms |
| publisher |
American Scientific Publishers |
| publishDate |
2014 |
| url |
http://psasir.upm.edu.my/id/eprint/36980/1/Density%20functional%20study%20of%20spin%20polarization%20on%20a%20carbon%20material%20with%20a%20hexagonal%20structure%20induced%20by%20iron%20atoms.pdf http://psasir.upm.edu.my/id/eprint/36980/ http://www.ingentaconnect.com/content/asp/jctn/2014/00000011/00000001/art00009?token=003f1b703b719b6f98c39412f415d766b2524702e7b457a3863382530332948 |
| _version_ |
1643831883008573440 |
| score |
13.250246 |