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arXiv 2008.05494cond-mat.str-elcond-mat.mtrl-sci
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典型笼目金属CoSn中关联电子态的温度依赖

Temperature dependence of correlated electronic states in archetypal kagome metal CoSn

Li Huang, Haiyan Lu

AI总结:

本文利用DFT+嵌入DMFT研究六方CoSn中笼目关联电子态的温度演化,发现其接近Mott绝缘态,并识别出六个与赝能隙、非费米液体、中间自旋、自旋冻结及轨道冻结相关的特征温度。

摘要:

六方CoSn是一种新发现的受挫笼目金属。它表现出接近教科书式的平带和轨道选择性狄拉克费米子,这些特征在很大程度上与其强关联的Co-3d轨道相关。由于关联电子态容易受到外部条件(如化学掺杂、压力和温度)的调控,这些笼目衍生电子能带随温度变化的命运成为一个有趣且尚未解决的问题。在本工作中,我们尝试利用密度泛函理论结合嵌入动力学平均场理论来研究六方CoSn的温度依赖电子结构。我们发现六方CoSn在常压条件下非常接近Mott绝缘态。我们特别关注其Co-3d电子态随温度的演化。至少确定了六个不同的温度(或能量尺度),即T*、T_FL、T_S1(和T_S2)、T_SF以及T̄。它们分别与“赝能隙”态的稳定化、非费米液体相的出现、中间自旋态的开始(和完成)、自旋冻结相的发生以及轨道冻结转变的开始相关。

英文摘要:

Hexagonal CoSn is a newly-discovered frustrated kagome metal. It shows close-to-textbook flat bands and orbital-selective Dirac fermions, which are largely associated with its strongly correlated Co-3$d$ orbitals. Because correlated electronic states are easily regulated by external conditions (such as chemical doping, pressure, and temperature), the fate of these kagome-derived electronic bands upon temperature becomes an interesting and unsolved question. In this work, we try to study the temperature-dependent electronic structures of hexagonal CoSn by means of the density functional theory in conjunction with the embedded dynamical mean-field theory. We find that hexagonal CoSn is in close proximity to a Mott insulating state at ambient condition. Special attention is devoted to the evolution of its Co-3$d$ electronic states with respect to temperature. At least six different temperatures (or energy scales), namely $T^{*}$, $T_{\text{FL}}$, $T_{\text{S1}}$ (and $T_{\text{S2}}$), $T_{\text{SF}}$, and $\bar{T}$, are figured out. They are related to stabilization of the "pseudogap" state, emergence of the non-Fermi-liquid phase, onset (and completeness) of the intermediate spin state, occurrence of the spin-frozen phase, beginning of the orbital freezing transition, respectively.

机构、总结、中文摘要均由AI分析而来,可能存在错误,请以论文正文为准。

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