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赫斯勒合金中三重简并费米子的拓扑特征:一项研究。

Topological signatures of triply degenerate fermions in Heusler alloys: anstudy.

作者信息

Dhori Bhautik R, Mohanta Aritri, Jha Prafulla K

机构信息

Department of Physics, Faculty of Science, The Maharaja Sayajirao University of Baroda, Vadodara, Gujarat 390002, India.

出版信息

J Phys Condens Matter. 2024 Oct 28;37(3). doi: 10.1088/1361-648X/ad8715.

Abstract

Triply degenerate nodal point (TP) fermions, lacking elementary particle counterparts, have been theoretically anticipated as quasiparticle excitations near specific band crossing points constrained by distinct space-group symmetries instead of Lorentz invariance. Here, based oncalculations and symmetry analysis, we demonstrate the presence of TP fermions in Heusler alloys. Furthermore, we predict that these Heusler alloys are dynamically stable, exhibiting TP fermions along four distinctaxes in the F-43m space group. We show that-LiCaPdSb harbours peculiar Fermi arcs and surface states on the (111) and (001) crystal facets, owing to the coexistence of threefold rotational and time reversal symmetry. More interestingly, a modest tensile strain can increase the distance of fermions along the Γ-high symmetric line by as much as 21.10%, which give rise to measurable Fermi arcs. Furthermore, we investigate non-trivial topological insulator phase in-LiCaPdSb, by changing the chemical environment through placing transition metal atoms at various Wyckoff positions. The-LiCaPdSb harbour a semi-metallic nature, and by breaking cubic symmetry, it undergoes a transition from semi-metal to a non-trivial topological insulator. In addition, for the first time, rare-earth LaPtBi half-Heusler alloy is examined under strain to uncover multiple band inversions associated with the TP fermionic phase. The observed multiple band inversion is entirely unaffected by spin-orbit coupling. We show that the LaPtBi compound hosts TP fermions, which are linked to aZ2topological invariant. Remarkably, with clear band crossings and multiple band inversion, we point out the possibilities of the LaPtBi for displaying a rich topological phase diagram. Our work provides a prototype material platform for experimental detection through angle-resolved photoemission spectroscopy or scanning tunnelling spectroscopy and practical spintronic applications.

摘要

三重简并节点(TP)费米子缺乏基本粒子对应物,理论上被预测为受特定空间群对称性而非洛伦兹不变性约束的特定能带交叉点附近的准粒子激发。在此,基于计算和对称性分析,我们证明了赫斯勒合金中存在TP费米子。此外,我们预测这些赫斯勒合金是动态稳定的,在F-43m空间群中沿四个不同轴表现出TP费米子。我们表明,-LiCaPdSb在(111)和(001)晶面上具有独特的费米弧和表面态,这是由于三重旋转对称性和时间反演对称性的共存。更有趣的是,适度的拉伸应变可使费米子沿Γ-高对称线的距离增加多达21.10%,从而产生可测量的费米弧。此外,我们通过将过渡金属原子置于不同的Wyckoff位置来改变化学环境,研究了-LiCaPdSb中的非平凡拓扑绝缘体相。-LiCaPdSb具有半金属性质,通过打破立方对称性,它从半金属转变为非平凡拓扑绝缘体。此外,首次在应变下研究了稀土LaPtBi半赫斯勒合金,以揭示与TP费米子相相关的多个能带反转。观察到的多个能带反转完全不受自旋轨道耦合的影响。我们表明,LaPtBi化合物包含与Z2拓扑不变量相关的TP费米子。值得注意的是,由于存在清晰的能带交叉和多个能带反转,我们指出了LaPtBi显示丰富拓扑相图的可能性。我们的工作为通过角分辨光电子能谱或扫描隧道谱进行实验检测以及实际的自旋电子学应用提供了一个原型材料平台。

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