No Arabic abstract
To clarify the nature of correlations in Hund metals and its relationship with Mott physics we analyze the electronic correlations in multiorbital systems as a function of intraorbital interaction U, Hunds coupling JH and electronic filling n. We show that the main process behind the enhancement of correlations in Hund metals is the suppression of the double-occupancy of a given orbital, as it also happens in the Mott-insulator at half-filling. However, contrary to what happens in Mott correlated states the reduction of the quasiparticle weight Z with JH can happen on spite of increasing charge fluctuations. Therefore, in Hund metals the quasiparticle weight and the mass enhancement are not good measurements of the charge localization. Using simple energetic arguments we explain why the spin polarization induced by Hunds coupling produces orbital decoupling. We also discuss how the behavior at moderate interactions, with correlations controlled by the atomic spin polarization, changes at large $U$ and $J_H$ due to the proximity to a Mott insulating state.
Orbital differentiation is a common theme in multiorbital systems, yet a complete understanding of it is still missing. Here, we consider a minimal model for orbital differentiation in Hund metals with a highly accurate method: We use the numerical renormalization group as a real-frequency impurity solver for a dynamical mean-field study of three-orbital Hubbard models, where a crystal field shifts one orbital in energy. The individual phases are characterized with dynamic correlation functions and their relation to diverse Kondo temperatures. Upon approaching the orbital-selective Mott transition, we find a strongly suppressed spin coherence scale and uncover the emergence of a singular Fermi liquid and interband doublon-holon excitations. Our theory describes the diverse polarization-driven phenomena in the $t_{2g}$ bands of materials such as ruthenates and iron-based superconductors, and our methodological advances pave the way towards real-frequency analyses of strongly correlated materials.
In correlated metals derived from Mott insulators, the motion of an electron is impeded by Coulomb repulsion due to other electrons. This phenomenon causes a substantial reduction in the electrons kinetic energy leading to remarkable experimental manifestations in optical spectroscopy. The high-Tc superconducting cuprates are perhaps the most studied examples of such correlated metals. The occurrence of high-Tc superconductivity in the iron pnictides puts a spotlight on the relevance of correlation effects in these materials. Here we present an infrared and optical study on single crystals of the iron pnictide superconductor LaFePO. We find clear evidence of electronic correlations in metallic LaFePO with the kinetic energy of the electrons reduced to half of that predicted by band theory of nearly free electrons. Hallmarks of strong electronic many-body effects reported here are important because the iron pnictides expose a new pathway towards a correlated electron state that does not explicitly involve the Mott transition.
We study the spontaneous emission of agglomerates of two-level quantum emitters embedded in a correlated transparent metal. The characteristic emission energy corresponds to the splitting between ground and excited states of a neutral, nonmagnetic molecular impurity (F color center), while correlations are due to the existence of narrow bands in the metal. This is the case of transition metal oxides with an ABO3 Perovskite structure, such as SrVO3 and CaVO3, where oxygen vacancies are responsible for the emission of visible light, while the correlated metallic nature arises from the partial filling of a band with mostly d-orbital character. For these systems we put forward an interdisciplinary, tunable mechanism to control light emission governed by electronic correlations. We show that not only there exists a critical value for the correlation strength above which the metal becomes transparent in the visible, but also that strong correlations can lead to a remarkable enhancement of the light-matter coupling. By unveiling the role of electronic correlations in spontaneous emission, our findings set the basis for the design of controllable, solid-state, single-photon sources in correlated transparent metals.
We address the question of the degree of spatial non-locality of the self energy in the iron-based superconductors, a subject which is receiving considerable attention. Using LiFeAs as a prototypical example, we extract the self energy from angular-resolved photoemission spectroscopy (ARPES) data. We use two distinct electronic structure references: density functional theory in the local density approximation and linearized quasiparticle self consistent GW (LQSGW). We find that with the LQSGW reference, spatially local dynamical correlations provide a consistent description of the experimental data, and account for some surprising aspects of the data such as the substantial out of plan dispersion of the electron Fermi surface having dominant xz/yz character. Hence, correlations effects can be separated into static non-local contributions well described by LQSGW and dynamical local contributions. Hall effect and resistivity data are shown to be consistent with this description.
Recently, intensive studies have revealed fascinating physics, such as charge density wave and superconducting states, in the newly synthesized kagome-lattice materials $A$V$_3$Sb$_5$ ($A$=K, Rb, Cs). Despite the rapid progress, fundamental aspects like the magnetic properties and electronic correlations in these materials have not been clearly understood yet. Here, based on the density functional theory plus the single-site dynamical mean-field theory calculations, we investigate the correlated electronic structure and the magnetic properties of the KV$_3$Sb$_5$ family materials in the normal state. We show that these materials are good metals with weak local correlations. The obtained Pauli-like paramagnetism and the absence of local moments are consistent with recent experiment. We reveal that the band crossings around the Fermi level form three groups of nodal lines protected by the spacetime inversion symmetry, each carrying a quantized $pi$ Berry phase. Our result suggests that the local correlation strength in these materials appears to be too weak to generate unconventional superconductivity, and non-local electronic correlation might be crucial in this kagome system.