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First-principles study on the magnetism of different dimensional Ru systems

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First-principles study on the magnetism of

different dimensional Ru systems

Zhu Qiu-Xiang;Pang Hua;Li Fa-Shen

【期刊名称】《中国物理:英文版》 【年(卷),期】2009(018)007

【摘要】The magnetism, the magnetocrystalline anisotropy and the optical properties of the monolayer and atomic chain of 4d transition-metal Ru are investigated by using the full-potential linearized-augmented-plane-wave

method

in

a

generalized

gradient

approximation. The magnetic moments are 1.039 μB/atom and 1.130 μB/atom for the monolayer and atomic chain, respectively. Both systems have large magnetocrystalline anisotropy energy (MAE). The magnetic easy axis is normal to the monolayer and perpendicular to the chain axis in the atomic chain. The optical properties of the two low-dimensional Ru systems are investigated by calculating the complex optical conductivity

tensor.

Both

systems

exhibit

anisotropy

in

photoconductivity, especially for the atomic chain. The physical origins of MAE and photoconductivity are studied based on electronic structures. It is found that the changes in crystal field caused by different symmetry-breaking mechanisms in the two low-dimensional Ru systems result in MAE through spin-orbit coupling, while the anisotropy in photoconductivity mainly comes from the crystallographic

anisotropy.

【总页数】8页(2953-2960) 【关键词】

【作者】Zhu Qiu-Xiang;Pang Hua;Li Fa-Shen

【作者单位】Key Laboratory tor Magnetism and Magnetic Materials of the Ministry of Education, Lanzhou University,Lanzhou 730000, China;Key Laboratory tor Magnetism and Magnetic Materials of the Ministry of Education, Lanzhou University,Lanzhou 730000, China;Key Laboratory tor Magnetism and Magnetic Materials of the Ministry of Education, Lanzhou University,Lanzhou 730000, China 【正文语种】中文 【中图分类】O4 【文献来源】

https://www.zhangqiaokeyan.com/academic-journal-cn_chinese-physics-b_thesis/0201251237945.html 【相关文献】

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First-principles study on the magnetism of different dimensional Ru systems

First-principlesstudyonthemagnetismofdifferentdimensionalRusystemsZhuQiu-Xiang;PangHua;LiFa-Shen【期刊名称】《中国物理:英文版》【年(卷),期】2009(018)007【摘要】Themagnet
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