Electronic and Magnetic Properties of Mn₂Sb₁₋xAs[x] (x = 0, 0.5, 1)
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- Kakimoto Takatoshi
- Graduate School of Science and Engineering, Kagoshima University
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- Goto Junya
- Graduate School of Science and Engineering, Kagoshima University
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- Fujii Shinpei
- Graduate School of Science and Engineering, Kagoshima University
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- Koyama Keiichi
- Graduate School of Science and Engineering, Kagoshima University
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- Ishida Shoji
- Graduate School of Science and Engineering, Kagoshima University
書誌事項
- タイトル別名
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- Electronic and Magnetic Properties of Mn<sub>2</sub>Sb<sub>1−</sub><i><sub>x</sub></i>As<i><sub>x</sub></i> (<I>x</I> = 0,0.5,1)
- Electronic and Magnetic Properties of Mn<sub>2</sub>Sb<sub>1−</sub><i><sub>x</sub></i>As<i><sub>x</sub></i> (<I>x</I> = 0,0.5,1)
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The electronic and magnetic properties of Mn2Sb1−xAsx (where x = 0,0.5,1) are investigated from first-principles total-energy calculations. The predicted magnetic ground states (ferrimagnetism for x = 0 and antiferromagnetism for x = 1) are in agreement with experimental observations; however, this is not the case for x = 0.5. Here, it is found that the artificial change of the surrounding atoms of Mn stabilizes the antiferromagnetism. A similar change stabilizes ferrimagnetism (antiferromagnetism) for x = 1 (x = 0). These results indicate that the environment around the Mn atoms plays a very important role in the stabilization of antiferromagnetism in the Mn2Sb1−xAsx system. In addition, an analysis of the sign of an effective exchange interaction as a function of the distance between the Mn atoms is performed.
収録刊行物
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- MATERIALS TRANSACTIONS
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MATERIALS TRANSACTIONS 55 (12), 1878-1884, 2014
公益社団法人 日本金属学会
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詳細情報 詳細情報について
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- CRID
- 1390001204254561024
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- NII論文ID
- 130004713120
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- NII書誌ID
- AA1151294X
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- ISSN
- 13475320
- 13459678
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- NDL書誌ID
- 025941268
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- 本文言語コード
- en
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- データソース種別
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- JaLC
- NDL
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