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Register a new userLocal Quantum Criticality of an Iron-Pnictide Tetrahedron
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Motivated by the close correlation between transition temperature ($T_c$) and the tetrahedral bond angle of the As-Fe-As layer observed in the iron-based superconductors, we study the interplay between spin and orbital physics of an isolated iron-arsenide tetrahedron embedded in a metallic environment. Whereas the spin Kondo effect is suppressed to low temperatures by Hunds coupling, the orbital degrees of freedom are expected to quantum mechanically quench at high temperatures, giving rise to an overscreened, non-Fermi liquid ground-state. Translated into a dense environment, this critical state may play an important role in the superconductivity of these materials.
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Many unconventional superconductors exhibit a common set of anomalous charge transport properties that characterize them as `strange metals, which provides hope that there is single theory that describes them. However, model-independent connections between the strange metal and superconductivity have remained elusive. In this letter, we show that the Hall effect of the unconventional superconductor BaFe$_2$(As$_{1-x}$P$_x$)$_2$ contains an anomalous contribution arising from the correlations within the strange metal. This term has a distinctive dependence on magnetic field, which allows us to track its behavior across the doping-temperature phase diagram, even under the superconducting dome. These measurements demonstrate that the strange metal Hall component emanates from a quantum critical point and, in the zero temperature limit, decays in proportion to the superconducting critical temperature. This creates a clear and novel connection between quantum criticality and superconductivity, and suggests that similar connections exist in other strange metal superconductors.
Ultrasonic measurements have been carried out to investigate the critical dynamics of structural and superconducting transitions due to degenerate orbital bands in iron pnictide compounds with the formula Ba(Fe$_{1-x}$Co$_x$)$_2$As$_2$. The attenuation coefficient $alpha_{mathrm{L}[110]}$ of the longitudinal ultrasonic wave for $(C_{11}+C_{12}+2C_{66})/2$ for $x = 0.036$ reveals the critical slowing down of the relaxation time around the structural transition at $T_mathrm{s} = 65$ K, which is caused by ferro-type ordering of the quadrupole $O_{x^2-y^2}$ coupled to the strain $varepsilon_{xy}$. The attenuation coefficient $alpha_{66}$ of the transverse ultrasonic wave for $C_{66}$ for $x = 0.071$ also exhibits the critical slowing down around the superconducting transition at $T_mathrm{SC} = 23$ K, which is caused by ferro-type ordering of the hexadecapole $H_z^alpha bigl( boldsymbol{r}_i, boldsymbol{r}_j bigr) = O_{xy}bigl( boldsymbol{r}_i bigr) O_{x^2 - y^2}bigl( boldsymbol{r}_j bigr) + O_{x^2 - y^2}bigl( boldsymbol{r}_i bigr) O_{xy}bigl( boldsymbol{r}_j bigr)$ of the bound two-electron state coupled to the rotation $omega_{xy}$. It is proposed that the hexadecapole ordering associated with the superconductivity brings about spontaneous rotation of the macroscopic superconducting state with respect to the host tetragonal lattice.
The twin issues of the nature of the normal state and competing order(s) in the iron arsenides are central to understanding their unconventional, high-Tc superconductivity. We use a combination of transport anisotropy measurements on detwinned Sr(Fe(1-x)Co(x))2As2 single crystals and local density approximation plus dynamical mean field theory (LDA + DMFT) calculations to revisit these issues. The peculiar resistivity anisotropy and its evolution with x are naturally interpreted in terms of an underlying orbital-selective Mott transition (OSMT) that gaps out the dxz or dyz states. Further, we use a Landau-Ginzburg approach using LDA + DMFT input to rationalize a wide range of anomalies seen up to optimal doping, providing strong evidence for secondary electronic nematic order. These findings suggest that strong dynamical fluctuations linked to a marginal quantum-critical point associated with this OSMT and a secondary electronic nematic order constitute an intrinsically electronic pairing mechanism for superconductivity in Fe arsenides.
We present an approach that combines the local density approximation (LDA) and the dynamical mean-field theory (DMFT) in the framework of the full-potential linear augmented plane waves (FLAPW) method. Wannier-like functions for the correlated shell are constructed by projecting local orbitals onto a set of Bloch eigenstates located within a certain energy window. The screened Coulomb interaction and Hunds coupling are calculated from a first-principle constrained RPA scheme. We apply this LDA+DMFT implementation, in conjunction with continuous-time quantum Monte-Carlo, to study the electronic correlations in LaFeAsO. Our findings support the physical picture of a metal with intermediate correlations. The average value of the mass renormalization of the Fe 3d bands is about 1.6, in reasonable agreement with the picture inferred from photoemission experiments. The discrepancies between different LDA+DMFT calculations (all technically correct) which have been reported in the literature are shown to have two causes: i) the specific value of the interaction parameters used in these calculations and ii) the degree of localization of the Wannier orbitals chosen to represent the Fe 3d states, to which many-body terms are applied. The latter is a fundamental issue in the application of many-body calculations, such as DMFT, in a realistic setting. We provide strong evidence that the DMFT approximation is more accurate and more straightforward to implement when well-localized orbitals are constructed from a large energy window encompassing Fe-3d, As-4p and O-2p, and point out several difficulties associated with the use of extended Wannier functions associated with the low-energy iron bands. Some of these issues have important physical consequences, regarding in particular the sensitivity to the Hunds coupling.
The Coulomb repulsion, impeding electrons motion, has an important impact on the charge dynamics. It mainly causes a reduction of the effective metallic Drude weight (proportional to the so-called optical kinetic energy), encountered in the optical conductivity, with respect to the expectation within the nearly-free electron limit (defining the so-called band kinetic energy), as evinced from band-structure theory. In principle, the ratio between the optical and band kinetic energy allows defining the degree of electronic correlations. Through spectral weight arguments based on the excitation spectrum, we provide an experimental tool, free from any theoretical or band-structure based assumptions, in order to estimate the degree of electronic correlations in several systems. We first address the novel iron-pnictide superconductors, which serve to set the stage for our approach. We then revisit a large variety of materials, ranging from superconductors, to Kondo-like systems as well as materials close to the Mott-insulating state. As comparison we also tackle materials, where the electron-phonon coupling dominates. We establish a direct relationship between the strength of interaction and the resulting reduction of the optical kinetic energy of the itinerant charge carriers.
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