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CoMnSb/HfIrSb 磁性隧道结中的自旋相关隧穿和应变敏感性:第一性原理研究

Spin dependent tunneling and strain sensitivity in a CoMnSb/HfIrSb magnetic tunneling junction: a first-principles study.

作者信息

Bhattacharya Joydipto, Rawat Ashima, Pati Ranjit, Chakrabarti Aparna, Pandey Ravindra

机构信息

Raja Ramanna Centre for Advanced Technology, Indore 452013, India.

Homi Bhabha National Institute, Training School Complex, Anushakti Nagar, Mumbai 400094, India.

出版信息

Phys Chem Chem Phys. 2024 Oct 17;26(40):26064-26075. doi: 10.1039/d4cp01850h.

DOI:10.1039/d4cp01850h
PMID:39377102
Abstract

Half-metallic Co-based full Heusler alloys have captured considerable attention of researchers in the realm of spintronic applications, owing to their remarkable characteristics such as exceptionally high spin polarization at the Fermi level, ultra-low Gilbert damping, and a high Curie temperature. In this comprehensive study, employing the density functional theory, we delve into the electronic stability and ballistic spin transport properties of a magnetic tunneling junction (MTJ) comprising a CoMnSb/HfIrSb interface. An in-depth investigation of -dependent spin transmissions uncovers the occurrence of coherent tunneling for the Mn-Mn/Ir interface, particularly when a spacer layer beyond a certain thickness is employed. It has been found that the Co-terminated CoMnSb/HfIrSb interface shows perpendicular magnetic anisotropy, while those with Mn-Sb and Mn-Mn termination exhibit in-plane magnetic anisotropy. Furthermore, our spin-dependent transmission calculations demonstrate that the Mn-Mn/Ir interface manifests strain-sensitive transmission properties under both compressive and tensile strain and yields a remarkable three-fold increase in majority spin transmission under tensile strain conditions. We find a tunnel magnetoresistance of ∼500% under a bi-axial strain of -3%, beyond which the tunnel resistance is found to be theoretically infinite. These compelling outcomes place the CoMnSb/HfIrSb junction among the highly promising candidates for nanoscale spintronic devices, emphasizing the potential significance of the system in the advancement of the field.

摘要

半金属钴基全赫斯勒合金因其在费米能级具有极高的自旋极化率、超低的吉尔伯特阻尼以及高居里温度等显著特性,在自旋电子学应用领域引起了研究人员的广泛关注。在这项全面的研究中,我们运用密度泛函理论,深入探究了由CoMnSb/HfIrSb界面构成的磁性隧道结(MTJ)的电子稳定性和弹道自旋输运特性。对依赖于[具体变量未给出]的自旋传输进行的深入研究发现,对于Mn-Mn/Ir界面会出现相干隧穿现象,特别是当使用超过一定厚度的间隔层时。研究发现,以Co为端的CoMnSb/HfIrSb界面表现出垂直磁各向异性,而以Mn-Sb和Mn-Mn为端的界面则表现出面内磁各向异性。此外,我们的自旋相关传输计算表明,Mn-Mn/Ir界面在压缩应变和拉伸应变下均表现出应变敏感的传输特性,并且在拉伸应变条件下多数自旋传输显著增加了三倍。我们发现在-3%的双轴应变下隧道磁电阻约为500%,超过该应变后理论上隧道电阻为无穷大。这些引人注目的结果使CoMnSb/HfIrSb结成为纳米级自旋电子器件极具潜力的候选者之一,突显了该系统在该领域发展中的潜在重要性。

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