论文标题

完全自旋偏振的节点链状态半金属liv $ _2 $ o $ _4 $

Fully spin-polarized nodal chain state in half metal LiV$_2$O$_4$

论文作者

Zhang, Haopeng, Zhang, Xiaoming, Liu, Ying, Dai, Xuefang, Chen, Guang, Liu, Guodong

论文摘要

作为物质的新拓扑状态,结节链费米子已经在非磁性材料中进行了热门讨论。在这里,通过使用第一原理计算和对称分析,我们提出了在liv $ _2 $ o $ $ _4 $复合的半金属状态下完全自旋偏置的节点链的实现。该材料自然显示出铁磁基态,并采用半米结构,只有来自费米水平附近的旋转通道的频带。旋转带相互交叉,形成两种类型的节点环。这些节点环由频带反转产生,并在滑行镜对称性的保护下。值得注意的是,我们发现淋巴结环相互结合并形成链状淋巴结结构。相应地,W形表面状态也完全自旋偏振。以前尚未在逼真的材料中提出,此处鉴定出的完全自旋偏振的淋巴结链。构建了一个有效的模型来描述节点链的性质。讨论了电子相关性,晶格应变和自旋轨道耦合的影响。半金属的完全自旋偏振的大块结节链和相关的非平凡表面状态可能在旋转中打开新的应用。

Nodal-chain fermions, as novel topological states of matter, have been hotly discussed in non-magnetic materials. Here, by using first-principles calculations and symmetry analysis, we propose the realization of fully spin-polarized nodal chain in the half-metal state of LiV$_2$O$_4$ compound. The material naturally shows a ferromagnetic ground state, and takes on a half-metal band structure with only the bands from the spin-up channel present near the Fermi level. The spin-up bands cross with each other, which form two types of nodal loops. These nodal loops arise from band inversion and are under the protection of the glide mirror symmetries. Remarkably, we find the nodal loops conjunct with each other and form chain-like nodal structure. Correspondingly, the w-shaped surface states are also fully spin-polarized. The fully spin-polarized nodal chain identified here has not been proposed in realistic materials before. An effective model is constructed to describe the nature of nodal chain. The effects of the electron correlation, the lattice strains, and the spin-orbit coupling are discussed. The fully spin-polarized bulk nodal-chain and the associated nontrivial surface states for a half-metal may open novel applications in spintronics.

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