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Fermi surface of layered compounds and bulk charge density wave systems

机译:层状化合物的费米面和体电荷密度波系统

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摘要

A review is given of recent angle-resolved photoemission (ARPES) experiments and analyses on a series of layered charge density wave materials. Important aspects of ARPES are recalled in view of its capability for bulk band, Fermi surface and spectral function mapping despite its surface sensitivity. Discussed are TaS, TaSe, NbTe, TiSe and TiTe with structures related to the so-called 1 polytype. Many of them undergo charge density wave transitions or exist with a distorted lattice structure. Attempts to explain the mechanism behind the structural reconstruction are given. Depending on the filling of the lowest occupied band a drastically different behaviour is observed. Whereas density functional calculations of the electronic energy and momentum distribution reproduce well the experimental spectral weight distribution at the Fermi energy, the ARPES energy distribution curves reveal that for some of the compounds the Fermi surface is pseudo-gapped. Two different explanations are given, the first based on density functional calculations accounting for the charge-density-wave-induced lattice distortion and the second relying on many-body physics and polaron formation. Qualitatively, both describe the observations well. However, in the future, in order to be selective, quantitative modelling will be necessary, including the photoemission matrix elements.
机译:审查了最近的角度分辨光发射(ARPES)实验,并分析了一系列分层的电荷密度波材料。考虑到ARPES的重要意义,尽管其具有表面敏感性,但仍具有体带,费米表面和光谱函数作图的能力。讨论了具有与所谓的1多型相关的结构的TaS,TaSe,NbTe,TiSe和TiTe。它们中的许多经历电荷密度波跃迁或存在畸变的晶格结构。试图解释结构重建背后的机制。取决于最低占用频带的填充,观察到完全不同的行为。电子能量和动量分布的密度泛函计算很好地重现了费米能量下的实验光谱权重分布,而ARPES能量分布曲线表明,对于某些化合物,费米表面是伪间隙。给出了两种不同的解释,一种是基于密度泛函计算的电荷密度波引起的晶格畸变,另一种是基于多体物理学和极化子形成的解释。定性地,两者都很好地描述了观察结果。然而,在将来,为了具有选择性,将需要包括光发射矩阵元素在内的定量建模。

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