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Spatially Modulated Electronic Nematicity in the Three-Band Model of Cuprate Superconductors

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 Added by William A. Atkinson
 Publication date 2013
  fields Physics
and research's language is English




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Charge order in cuprate superconductors is a possible source of anomalous electronic properties in the underdoped regime. Intra-unit cell charge ordering tendencies point to electronic nematic order involving oxygen orbitals. In this context we investigate charge instabilities in the Emery model and calculate the charge susceptibility within diagrammatic perturbation theory. In this approach, the onset of charge order is signalled by a divergence of the susceptibility. Our calculations reveal three different kinds of order: a commensurate ($q=0$) nematic order, and two incommensurate nematic phases with modulation wavevectors that are either axial or oriented along the Brillouin zone diagonal. We examine the nematic phase diagram as a function of the filling, the interaction parameters, and the band structure. We also present results for the excitation spectrum near the nematic instability, and show that a soft nematic mode emerges from the particle-hole continuum at the transition. The Fermi surface reconstructions that accompany the modulated nematic phases are discussed with respect to their relevance for magneto-oscillation and photoemission measurements. The modulated nematic phases that emerge from the three-band Emery model are compared to those found previously in one-band models.



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Recently, complex phase transitions accompanied by the rotational symmetry breaking have been discovered experimentally in cuprate superconductors. To find the realized order parameters, we study various charge susceptibilities in an unbiased way, by applying the functional-renormalization-group method to the realistic $d$-$p$ Hubbard model. Without assuming the wavevector of the order parameter, we reveal that the most dominant instability is the uniform ($q = 0$) charge modulation on the $p_x$ and $p_y$ orbitals, which possesses the d-symmetry. This uniform nematic order triggers another nematic p-orbital density wave along the axial (Cu-Cu) direction at $Q_a = (pi/2,0)$. It is predicted that uniform nematic order is driven by the spin fluctuations in the pseudogap region, and another nematic density-wave order at $q = Q_a$ is triggered by the uniform order. The predicted multistage nematic transitions are caused by the Aslamazov-Larkin-type fluctuation-exchange processes.
Nematicity is a well known property of liquid crystals and has been recently discussed in the context of strongly interacting electrons. An electronic nematic phase has been seen by many experiments in certain strongly correlated materials, in particular, in the pseudogap phase generic to many hole-doped cuprate superconductors. Recent measurements in high $T_c$ superconductors has shown even if the lattice is perfectly rotationally symmetric, the ground state can still have strongly nematic local properties. Our study of the two-dimensional Hubbard model provides strong support of the recent experimental results on local rotational $C_4$ symmetry breaking. The variational cluster approach is used here to show the possibility of an electronic nematic state and the proximity of the underlying symmetry-breaking ground state within the Hubbard model. We identify this nematic phase in the overdoped region and show that the local nematicity decreases with increasing electron filling. Our results also indicate that strong Coulomb interaction may drive the nematic phase into a phase similar to the stripe structure. The calculated spin (magnetic) correlation function in momentum space shows the effects resulting from real-space nematicity.
The cuprate superconductors are characterized by numerous ordering tendencies, with the nematic order being the most distinct form of order. Here the intertwinement of the electronic nematicity with superconductivity in cuprate superconductors is studied based on the kinetic-energy-driven superconductivity. It is shown that the optimized Tc takes a dome-like shape with the weak and strong strength regions on each side of the optimal strength of the electronic nematicity, where the optimized Tc reaches its maximum. This dome-like shape nematic-order strength dependence of Tc indicates that the electronic nematicity enhances superconductivity. Moreover, this nematic order induces the anisotropy of the electron Fermi surface (EFS), where although the original EFS with the four-fold rotation symmetry is broken up into that with a residual two-fold rotation symmetry, this EFS with the two-fold rotation symmetry still is truncated to form the Fermi arcs with the most spectral weight that locates at the tips of the Fermi arcs. Concomitantly, these tips of the Fermi arcs connected by the wave vectors ${bf q}_{i}$ construct an octet scattering model, however, the partial wave vectors and their respective symmetry-corresponding partners occur with unequal amplitudes, leading to these ordered states being broken both rotation and translation symmetries. As a natural consequence, the electronic structure is inequivalent between the $k_{x}$ and $k_{y}$ directions. These anisotropic features of the electronic structure are also confirmed via the result of the autocorrelation of the single-particle excitation spectra, where the breaking of the rotation symmetry is verified by the inequivalence on the average of the electronic structure at the two Bragg scattering sites. Furthermore, the strong energy dependence of the order parameter of the electronic nematicity is also discussed.
Electronic nematicity is an important order in most iron-based superconductors, and FeSe represents a unique example, in which nematicity disentangles from spin ordering. It is commonly perceived that this property arises from strong electronic correlation, which can not be properly captured by density functional theory (DFT). Here, we show that by properly considering the paramagnetic condition and carefully searching the energy landscape with symmetry-preconditioned wavefunctions, two nematic solutions stand out at either the DFT+$U$ or hybrid functional level, both of which are lower in energy than the symmetric solution. The ground-state band structure and Fermi surface can be well compared with the recent experimental results. Symmetry analysis assigns these two new solutions to the $B_{1g}$ and $E_u$ irreducible representations of the D$_{4h}$ point group. While the $B_{1g}$ Ising nematicity has been widely discussed in the context of vestigial stripe antiferromagnetic order, the two-component $E_u$ vector nematicity is beyond previous theoretical discussion. Distinct from the $B_{1g}$ order, the $E_u$ order features mixing of the Fe $d$-orbitals and inversion symmetry breaking, which lead to striking experimental consequences, e.g. missing of an electron pocket.
Electronic nematic phases have been proposed to occur in various correlated electron systems and were recently claimed to have been detected in scanning tunneling microscopy (STM) conductance maps of the pseudogap states of the cuprate high-temperature superconductor Bi2Sr2CaCu2O8+x (Bi-2212). We investigate the influence of anisotropic STM tip structures on such measurements and establish, with a model calculation, the presence of a tunneling interference effect within an STM junction that induces energy-dependent symmetry-breaking features in the conductance maps. We experimentally confirm this phenomenon on different correlated electron systems, including measurements in the pseudogap state of Bi-2212, showing that the apparent nematic behavior of the imaged crystal lattice is likely not due to nematic order but is related to how a realistic STM tip probes the band structure of a material. We further establish that this interference effect can be used as a sensitive probe of changes in the momentum structure of the samples quasiparticles as a function of energy.
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