arXivDaily arXiv每日学术速递 周一至周五更新
arXiv 2301.07985cond-mat.mtrl-sci
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MnTe中的反铁磁性、自旋分裂与自旋轨道相互作用

Antiferromagnetism, spin splitting, and spin-orbit interaction in MnTe

Suman Rooj, Jayita Chakraborty, Nirmal Ganguli

AI总结:

该研究用密度泛函理论、蒙特卡洛和对称性分析揭示六方MnTe的反铁磁绝缘态、大自旋分裂、K点附近Rashba-Dresselhaus相互作用及高能构型铁电性。

摘要:

六方MnTe正成为设计磁性量子异质结构的关键组分,因此需要对其进行详细研究。在找到交换关联泛函与修正的合适组合后,我们在从头算密度泛函理论框架内开展的研究揭示出一种具有择优反铁磁序的绝缘态。我们计算了交换相互作用强度,以通过蒙特卡洛计算估算反铁磁有序温度。计算和对称性分析表明,由于反铁磁序的存在,即使不考虑自旋轨道相互作用,该体系也会出现大的自旋分裂,但$k_x$-$k_y$平面除外。通过严格检验计算得到的能带色散和自旋织构,并将其与富有洞见的对称性分析和解析模型进行比较,我们确认在体系K点附近的$k_x$-$k_y$平面内存在Rashba-Dresselhaus联合相互作用。最后,我们在一种较高能量的磁性构型中发现了铁电性。我们的结果和见解将有助于设计面向技术应用的MnTe异质结构。

英文摘要:

Hexagonal MnTe emerges as a critical component in designing magnetic quantum heterostructures, calling for a detailed study. After finding a suitable combination of exchange-correlation functional and corrections, our study within {\em ab initio} density functional theory uncovers an insulating state with a preferred antiferromagnetic order. We compute the exchange interaction strengths to estimate the antiferromagnetic ordering temperature via Monte Carlo calculations. Our calculations and symmetry analysis reveal a large spin splitting in the system due to the antiferromagnetic order without considering spin-orbit interaction, except in the $k_x$-$k_y$ plane. Critically examining the band dispersion and spin textures obtained from our calculations and comparing them with an insightful symmetry analysis and analytical model, we confirm a combined Rashba-Dresselhaus interaction in the $k_x$-$k_y$ plane, around the K point of the system. Finally, we find ferroelectricity in the system for a higher energy magnetic configuration. Our results and insights would help design heterostructures of MnTe for technological applications.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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