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arXiv 2302.03993cond-mat.str-el
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三次拉什巴自旋轨道耦合引起的磁性杂质可调关联效应

Tunable correlation effects of magnetic impurities by the cubic Rashba spin-orbit couplings

Xiong-Tao Peng, Fang Lin, Liang Chen, Lin Li, Dong-Hui Xu, Jin-Hua Sun

AI总结:

研究三次拉什巴自旋轨道耦合对磁性杂质关联效应的影响,发现其可调谐局域磁矩并产生自旋关联的三重或六重对称性,可作为区分三次与线性拉什巴效应的实验标识。

摘要:

我们通过结合变分方法和Hirsch-Fye量子蒙特卡洛(HFQMC)模拟,从理论上研究了$k$-三次拉什巴自旋轨道耦合(SOC)对磁性杂质关联效应的影响。与普通的$k$-线性拉什巴SOC显著不同,即使很小的三次拉什巴项也能极大地改变能带结构,并在广泛的能量范围内诱发范霍夫奇点,因此单个杂质的局域磁矩变得高度可调。本工作采用的三次拉什巴SOC破坏了旋转对称性,但宿主材料在操作$\nmathcal{R}^z(π)$、$\mathcal{IR}^z(π/2)$、$\mathcal{M}_{xz}$、$\mathcal{M}_{yz}$下仍然不变,其中$\mathcal{R}^z(θ)$是绕$z$轴旋转角度$θ$的操作,$\mathcal{I}$是反演算符,$\mathcal{M}_{xz}$($\mathcal{M}_{yz}$)是关于$x$-$z$($y$-$z$)主平面的镜像反射。显著地,单个磁性杂质与传导电子之间的自旋-自旋关联的各分量表现出三重或六重旋转对称性。这一独特特征源于$\mathbf{k}$旋转$2π$时自旋的三重缠绕,这是三次拉什巴效应的标志,并可能成为在实验中区分三次拉什巴SOC与普通$k$-线性拉什巴项的标识符。尽管三次拉什巴项极大地改变了宿主的电子性质,我们发现自旋-自旋关联函数的空间衰减率基本保持不变。此外,两个磁性杂质之间由载流子介导的鲁德曼-基特尔-卡苏亚-芳田相互作用表现出扭曲特征,当两个磁性杂质非常接近时,铁磁对角项占主导,但在长距离时非对角项变得重要。

英文摘要:

We theoretically study the influence of the $k$-cubic Rashba spin-orbit coupling (SOC) on the correlation effects of magnetic impurities by combining the variational method and the Hirsch-Fye quantum Monte Carlo (HFQMC) simulations. Markedly different from the normal $k$-linear Rashba SOC, even a small cubic Rashba term can greatly alter the band structure and induce a Van Hove singularity in a wide range of energy, thus the single impurity local moment becomes largely tunable. The cubic Rashba SOC adopted in this work breaks the rotational symmetry, but the host material is still invariant under the operations $\mathcal{R}^z(π)$, $\mathcal{IR}^z(π/2)$, $\mathcal{M}_{xz}$, $\mathcal{M}_{yz}$, where $\mathcal{R}^z(θ)$ is the rotation of angle $θ$ about the $z$-axis, $\mathcal{I}$ is the inversion operator and $\mathcal{M}_{xz}$ ($\mathcal{M}_{yz}$) is the mirror reflection about the $x$-$z$ ($y$-$z$) principal plane. Saliently, various components of spin-spin correlation between the single magnetic impurity and the conduction electrons show three- or six-fold rotational symmetry. This unique feature is due to the triple winding of the spins with a $2π$ rotation of $\mathbf{k}$, which is a hallmark of the cubic Rashba effect and can possibly be an identifier to distinguish the cubic Rashba SOC from the normal $k$-linear Rashba term in experiments. Although the cubic Rashba term drastically alters the electronic properties of the host, we find that the spatial decay rate of the spin-spin correlation function remains essentially unchanged. Moreover, the carrier-mediated Ruderman-Kittel-Kasuya-Yosida interactions between two magnetic impurities show twisted features, the ferromagnetic diagonal terms dominate when two magnetic impurities are very close, but the off-diagonal terms become important at long distances.

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