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arXiv 1801.03532cond-mat.str-el
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掺杂扩展哈伯德模型中的电荷有序和非局域关联

Charge ordering and non-local correlations in the doped extended Hubbard model

Hanna Terletska, Tianran Chen, Joseph Paki, Emanuel Gull

摘要:

我们利用团簇动力学平均场论研究了二维正方形晶格上远离半填充的扩展哈伯德模型,团簇大小为$8$。我们表明,该模型具有金属,可压缩的电荷有序,绝缘电荷有序相。我们确定的位置的电荷有序相变线在有限的温度和作为掺杂,温度,局部相互作用,和最近邻相互作用的函数的相位的属性。对电荷有序跃迁的能量学分析表明,电荷有序跃迁主要导致局域势能和非局域势能的重排。我们展示了从各向同性金属到电荷有序金属到具有大间隙的电荷有序绝缘体的谱函数的掺杂演化,并研究了近似的有限尺寸效应。

英文摘要:

We study the extended Hubbard model away from half-filling on a two-dimensional square lattice using cluster dynamical mean field theory on clusters of size $8$. We show that the model exhibits metallic, compressible charge ordered, and insulating charge ordered phases. We determine the location of the charge ordering phase transition line at finite temperature and the properties of the phases as a function of doping, temperature, local interaction, and nearest neighbor interaction. An analysis of the energetics of the charge order transition shows that the charge ordering transition mainly results in a rearrangement of local and non-local potential energy. We show the doping evolution of the spectral function from the isotropic metal via a charge ordered metal to a charge ordered insulator with a big gap, and study finite size effects of the approximation.

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