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Register a new userEvidence for the coexistence between linearly dispersing bands and strong electronic correlations in the underlying kagome lattice of Na2/3CoO2
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Electronic topology in metallic kagome compounds is under intense scrutiny. We present transport experiments in Na2/3CoO2 in which the Na order differentiates a Co kagome sub-lattice in the triangular CoO2 layers. Hall and magnetoresistance (MR) data under high fields give evidence for the coexistence of light and heavy carriers. At low Ts, the dominant light carrier conductivity at zero field is suppressed by a B-linear MR suggesting Dirac like quasiparticles. Lifshitz transitions induced at large B and T unveil the lower mobility carriers. They display a negative B^2 MR due to scattering from magnetic moments likely pertaining to a flat band. We underline an analogy with heavy Fermion physics.
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We report a complete set of $^{59}$Co NMR data taken on the $x=2/3$ phase of sodium cobaltates Na$_{x}$CoO$_{2}$, for which we have formerly established the in plane Na ordering and its three dimensional stacking from a combination of symmetry arguments taken from Na and Co NQR/NMR data. Here we resolve all the parameters of the Zeeman and quadrupolar Hamiltonians for all cobalt sites in the unit cell and report the temperature dependencies of the NMR shift and spin lattice relaxation $T_{1}$ data for these sites. We confirm that three non-magnetic Co$^{3+}$ (Co1) are in axially symmetric positions and that the doped holes are delocalized on the nine complementary magnetic cobalt sites (Co2) of the atomic unit cell. The moderately complicated atomic structure resumes then in a very simple electronic structure in which the electrons delocalize on the Co2 kagome sublattice of the triangular lattice of Co sites. The observation of a single temperature dependence of the spin susceptibilities indicates that a single band picture applies, and that the magnetic properties are dominated by the static and dynamic electronic properties at the Co2 sites. We evidence that they display a strong in plane electronic anisotropy initially unexpected but which accords perfectly with an orbital ordering along the kagome sublattice organization. These detailed data should now permit realistic calculations of the electronic properties of this compound in order to determine the incidence of electronic correlations.
We report $^{23}$Na and $^{59}$Co nuclear magnetic (NMR) and quadrupolar resonance (NQR) studies for the $x=2/3$ phase of the lamellar oxide Na$_{x}$CoO$_{2}$, which allowed us to establish reliably the atomic order of the Na layers and their stacking between the CoO$_{2}$ slabs. We evidence that the Na$^{+}$ order stabilizes filled non magnetic Co$^{3+}$ ions on 25% of the cobalt sites arranged in a triangular sublattice. The transferred holes are delocalized on the 75% complementary cobalt sites which unexpectedly display a planar cobalt kagom{e} structure. These experimental results resolve a puzzling issue by precluding localized moments pictures for the magnetic properties. They establish that the quasi ferromagnetic properties result from a narrow band connecting a frustrated arrangement of atomic orbitals, and open the route to unravel through similar studies the electronic properties of the diverse ordered phases of sodium cobaltates.
The incidence of topology on the band structure and physical properties of layered compounds has been extensively studied in semimetals. How those evolve in presence of electronic correlations has been less investigated so far. In the sodium cobaltates NaxCoO2 considered here, unexpected magnetic properties associated with correlations on the Co sites have been disclosed about 15 years ago. The distinct Na orders of the stable phases of these cobaltates have been shown to induce specific Co charge disproportionation with large size unit cells in the CoO2 planes, linked with the diverse magnetic behaviors. This provides an original playground in the studies of interplays between topology and correlations in these layered materials. We present here transport measurements on a series of single crystals and demonstrate that we do synthetize pure phases with quite reproducible transport properties. We show that above room T those display a similar behavior whatever the Na content. On the contrary we provide evidence for a great diversity in Hall effect low temperature dependences which underlines the specificities of the Fermi Surface reconstructions induced by the Na order. We study in some detail the difference between two metallic phases, one (x = 0.77) antiferromagnetic below TN = 22 K and the second (x = 2/3) paramagnetic down to T = 0. Both show a sign change in the Hall effect with decreasing T. We demonstrate that this can be attributed to quite distinct physical effects. For the x = 0.77 phase the negative Hall effect occurs in similar conditions to the anomalous Hall effect found in various magnetic metals. In the x = 2/3 phase have to be assigned to specificities of its Fermi surface. In both cases the anomalies detected in the Hall effect are certainly associated with the topology of their Co electronic bands.
The importance of electronic correlation effects in the layered perovskite Sr$_2$RuO$_4$ is evidenced. To this end we use state-of-the-art LDA+DMFT (Local Density Approximation + Dynamical Mean-Field Theory) in the basis of Wannier functions to compute spectral functions and the quasiparticle dispersion of Sr$_2$RuO$_4$. The spectra are found to be in good agreement with various spectroscopic experiments. We also calculate the $textbf{k}$-dependence of the quasiparticle bands and compare the results with new angle resolved photoemission (ARPES) data. Two typical manifestations of strong Coulomb correlations are revealed: (i) the calculated quasiparticle mass enhancement of $m^*/m approx2.5$ agrees with various experimental results, and (ii) the satellite structure at about 3 eV binding energy observed in photoemission experiments is shown to be the lower Hubbard band. For these reasons Sr$_2$RuO$_4$ is identified as a strongly correlated 4$d$ electron material.
We compute the phonon dispersion, density of states, and the Gruneisen parameters of bulk palladium in the combined density functional theory (DFT) and dynamical mean-field theory (DMFT). We find good agreement with experimental results for ground state properties (equilibrium lattice parameter and bulk modulus) and the experimentally measured phonon spectra. We demonstrate that at temperatures $T lesssim 20~K$ the phonon frequency in the vicinity of the Kohn anomaly, $omega_{T1}({bf q}_{K})$, strongly decreases. This is in contrast to DFT where this frequency remains essentially constant in the whole temperature range. Apparently correlation effects reduce the restoring force of the ionic displacements at low temperatures, leading to a mode softening.
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