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arXiv 2403.09147cond-mat.str-el
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部分平带材料中的Stoner铁磁性、关联金属与热电性

Stoner ferromagnetism, correlated metal and thermoelectricity in partially flat-band materials

Leyla Majidi, Abolhassan Vaezi, Mehdi Kargarian

AI总结:

本研究提出部分平带正方晶格模型,利用Hubbard模型和动力学平均场理论,证明弱相互作用下产生Stoner铁磁性、高居里温度及平带诱导态密度峰,并展示其优异热电性能。

摘要:

扭曲异质结构中关联电子相的最新发现,激发了人们对具有平带(电子激发在动量空间中几乎无色散)的模型和材料的研究兴趣。因此,动能被抑制,关联增强,从而产生大量异常的磁性、超导和输运行为。寻找能带完全平坦的材料相当具有挑战性,但那些色散仅在动量空间的一部分平坦的材料在材料搜索中可能更容易获得。在这项工作中,我们提出了一个在正方晶格上的部分平带系统。利用Hubbard模型,我们证明了在带色散的平坦部分中电子动能的抑制驱动系统即使在非常弱的相互作用下(即远小于带宽)也能进入Stoner铁磁性,并显著提高居里温度。虽然低能磁振子模式是定义明确的集体激发,但在高能下可以观察到平坦的磁振子带。我们表明强相互作用导致磁振子带平坦部分的减少。然而,在强相互作用区域调节化学势可能导致有限波矢下的自旋密度波。然后,专注于非磁性关联相并使用动力学平均场理论,我们证明了在关联诱导的Mott带之外,出现了平带诱导的态密度尖锐峰。此外,与对称的常规带模型相比,所提出的部分平带模型具有大的塞贝克系数和品质因数,使其属于高效热电材料类别。

英文摘要:

Recent discovery of correlated electronic phases in twisted heterostructures raised a surge of interests in studying models and materials with flat bands where the electronic excitations are nearly dispersionless in momentum space. As such, the kinetic energy is quenched and the correlations are enhanced, giving rise to a plethora of unusual magnetic, superconducting and transport behaviors. Finding materials whose energy bands are completely flat is rather challenging, yet those whose dispersion is flat only in a portion of the momentum space might be more accessible in material search. In this work, we propose a partially flat-band system on a square lattice. Using the Hubbard model, it is demonstrated that the suppression of the electronic kinetic energy in the flat portion of the band dispersion drives the system to Stoner ferromagnetism even at very weak interactions, i.e., much smaller than the bandwidth, with significantly enhanced Curie temperature. While the low-energy magnon modes are well defined collective excitations, flat magnon bands can be observed at high energies. We show that the strong interaction leads to reduction of the flat portion of the magnon band. However, tuning the chemical potential at a strong interaction regime may lead to spin density wave at finite wave vectors. Then, focusing on the non-magnetic correlated phase and using dynamical mean-field theory, we demonstrate the appearance of a flat-band induced sharp peak in the density of states in addition to the correlation-induced Mott bands. Furthermore, the large seebeck coefficient and the figure of merit of the proposed partially flat-band model, compared to symmetric regular band models, put them in the category of efficient thermoelectric materials.

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