论文标题

Nematic Bani $ _2 $ as $ _2 $

Soft-phonon and charge-density-wave formation in nematic BaNi$_2$As$_2$

论文作者

Souliou, S. M., Lacmann, T., Heid, R., Meingast, C., Frachet, M., Paolasini, L., Haghighirad, A. -A., Merz, M., Bosak, A., Tacon, M. Le

论文摘要

我们使用弥漫性和非弹性X射线散射来研究BANI $ _2 $中的不稳定的电荷密度波(I-CDW)的形成为$ _2 $,这是一种用于电荷驱动的电子态性的候选系统。围绕I-CDW的调制向量,$ q_ {i-cdw} $观察到强烈的散射散射。它已经在室温下可见,并在发生小小的正骨变形的远程有序状态下塌陷成上层建筑反射。在$ q_ {i-cdw} $左右的情况下,观察到低能横向光学声子模式的分散体中的清晰倾角。冷却后,声子不断变软,最终将过渡到I-CDW状态。软音波分支的横向特征阐明了在当前和早期研究中观察到的I-CDW卫星的复杂模式,并解决了I-CDW的辩论单向性质。我们的$ {ab} $ {initiO} $计算很好地捕获了声子不稳定性及其相互空间位置。然而,这些表明,费米表面嵌套,也不能增强动量依赖性电子偶联,无法解释I-CDW的形成,表明其非常规性。%。%并提出了I-CDW的替代起源。

We use diffuse and inelastic x-ray scattering to study the formation of an incommensurate charge-density-wave (I-CDW) in BaNi$_2$As$_2$, a candidate system for charge-driven electronic nematicity. Intense diffuse scattering is observed around the modulation vector of the I-CDW, $Q_{I-CDW}$. It is already visible at room temperature and collapses into superstructure reflections in the long-range ordered state where a small orthorhombic distortion occurs. A clear dip in the dispersion of a low-energy transverse optical phonon mode is observed around $Q_{I-CDW}$. The phonon continuously softens upon cooling, ultimately driving the transition to the I-CDW state. The transverse character of the soft-phonon branch elucidates the complex pattern of the I-CDW satellites observed in the current and earlier studies and settles the debated unidirectional nature of the I-CDW. The phonon instability and its reciprocal space position is well captured by our ${ab}$ ${initio}$ calculations. These however indicate that neither Fermi surface nesting, nor enhanced momentum-dependent electron-phonon coupling can account for the I-CDW formation, demonstrating its unconventional nature.% and suggest alternative origins of the I-CDW.

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