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arXiv:0803.0752 · Physical Review B

Sum-rules for Raman scattering off strongly correlated electron systems

Luca de’ Medici, Antoine Georges, Gabriel Kotliar

Published Jun 23, 2008• 10 citations
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Abstract

We investigate sum-rules applying to the Raman intensity in a strongly correlated system close to the Mott transition. Quite generally, it can be shown that provided the frequency integration is performed up to a cutoff smaller than the upper Hubbard band a sum-rule applies to the nonresonant Raman signal of a doped Mott insulator, resulting in an integrated intensity, which is proportional to the doping level. We provide a detailed derivation of this sum-rule for the $t\text{\ensuremath{-}}J$ model for which the frequency cutoff can be taken to infinity and an unrestricted sum-rule applies. A quantitative analysis of the sum-rule is also presented for the $d$-wave superconducting phase of the $t\text{\ensuremath{-}}J$ model, using slave-boson methods. The case of the Hubbard model is studied in the framework of dynamical mean-field theory, with special attention to the cut-off dependence of the restricted sum-rule and also to the intermediate coupling regime. The sum-rule investigated here is shown to be consistent with recent experimental data on cuprate superconductors, reporting measurements of Raman scattering intensities on an absolute scale.

DOI
10.1103/physrevb.77.245128

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We investigate sum-rules applying to the Raman intensity in a strongly correlated system close to the Mott transition. Quite generally, it can be shown that provided the frequency integration is performed up to a cutoff smaller than the upper Hubbard band a sum-rule applies to the nonresonant Raman signal of a doped Mott insulator, resulting in an integrated intensity, which is proportional to the doping level. We provide a detailed derivation of this sum-rule for the t\ensuremath-Jt\text{\ensuremath{-}}Jt\ensuremath-J model for which the frequency cutoff can be taken to infinity and an unrestricted sum-rule applies. A quantitative analysis of the sum-rule is also presented for the ddd-wave superconducting phase of the t\ensuremath-Jt\text{\ensuremath{-}}Jt\ensuremath-J model, using slave-boson methods. The case of the Hubbard model is studied in the framework of dynamical mean-field theory, with special attention to the cut-off dependence of the restricted sum-rule and also to the intermediate coupling regime. The sum-rule investigated here is shown to be consistent with recent experimental data on cuprate superconductors, reporting measurements of Raman scattering intensities on an absolute scale.
We present a systematic study of spin dynamics in a superconducting ground state, which itself is a doped Mott insulator and can correctly reduce to an antiferromagnetic (AF) state at half-filling with an AF long-range order (AFLRO). Such a doped Mott insulator is described by a mean-field theory based on the phase string formulation of the $t\text{\ensuremath{-}}J$ model. We show that the well-known spin wave excitation in the AFLRO state at half-filling evolves into a resonancelike peak at a finite energy in the superconducting state, which is located around the AF wave vectors. The width of such a resonancelike peak in momentum space decides a spin correlation length scale which is inversely proportional to the square root of doping concentration, while the energy of the resonancelike peak scales linearly with the doping concentration at low doping. These properties are consistent with experimental observations in the high-Tc{T}_{c}Tc​ cuprates. An important prediction of the theory is that, while the total spin sum rule is satisfied at different doping concentrations, the weight of the resonancelike peak does not vanish, but is continuously saturated to the weight of the AFLRO at zero-doping limit. Besides the low-energy resonancelike peak, we also show that the high-energy excitations still track the spin wave dispersion in momentum space, contributing to a significant portion of the total spin sum rule. The fluctuational effect beyond the mean-field theory is also examined, which is related to the broadening of the resonancelike peak in energy space. In particular, we discuss the incommensurability of the spin dynamics by pointing out that its visibility is strongly tied to the low-energy fluctuations below the resonancelike peak. We finally investigate the interlayer coupling effect on the spin dynamics as a function of doping, by considering a bilayer system.
In this paper we investigate the zero-temperature doping-driven evolution of a superconductor toward the Mott insulator in a two-dimensional electron model, relevant for high-temperature superconductivity. To this purpose we use a cluster extension of dynamical mean-field theory. Our results show that a standard ddd-wave superconductor, realized at high doping, is driven into the Mott insulator via an intermediate superconducting state displaying unconventional physical properties. By restoring the translational invariance of the lattice, we give an interpretation of these findings in momentum space. In particular, we show that at a finite doping a strong momentum-space differentiation takes place: non-Fermi liquid and insulatinglike (pseudogap) characters rise in some regions (antinodes), while Fermi liquid quasiparticles survive in other regions (nodes) of momentum space. We describe the consequence of these happenings on the spectral properties, stressing in particular the behavior of the superconducting gap, which reveals two distinct nodal and antinodal energy scales as a function of doping, detected in photoemission and Raman spectroscopy experiments. We study and compare with experimental results the doping-dependent behavior of other physical quantities, such as for instance, the nodal quasiparticle velocity (extracted in angle-resolved photoemission) and the low-energy slopes of the local density of states and of the Raman scattering response. We then propose a description of the evolution of the electronic structure while approaching the Mott transition. We show that, within our formalism, a strong asymmetry naturally arises in the local density of states, measured in scanning tunneling spectroscopy. We investigate in detail the doping evolution of the electronic bands, focusing on the kinklike quasiparticle dispersion observed with angle-resolved photoemission in specific cuts of the momentum-energy space. We finally show the consequences of the properties presented above in the doping dependence of the Hall resistivity, measured in magnetotransport experiments.
We solve for the electronic Raman scattering response functions on an infinite-dimensional hypercubic lattice employing dynamical mean-field theory. This contribution extends previous work on the nonresonant response to include the mixed and resonant contributions. We focus our attention on the infinite-dimensional spinless Falicov-Kimball model, where the problem can be solved exactly, and the system can be tuned to go through a Mott-Hubbard-like metal-insulator transition. Resonant effects vary in different scattering geometries, corresponding to the symmetries of the charge excitations scattered by the light. We do find that the Raman response is large near the double resonance, where the transfered frequency is close to the incident photon frequency. We also find a joint resonance of both the charge-transfer peak and the low-energy peak when the incident photon frequency is on the order of the interaction strength. In general, the resonance effects can create order of magnitude (or more) enhancements of features in the nonresonant response, especially when the incident photon frequency is somewhat larger than the frequency of the nonresonant feature. Finally, we find that the resonant effects also exhibit isosbestic behavior, even in the A1g{A}_{1\mathrm{g}}A1g​ and B2g{B}_{2\mathrm{g}}B2g​ sectors, and it is most prominent when the incident photon frequency is on the order of the interaction energy.
Slave boson mean-field studies of the ground state of the Hubbard model with correlated hopping were performed. The approach qualitatively recovers the exact results for the case when the hopping integral ttt equals the correlated hopping integral X.X.X. The phase diagram for the strongly correlated state with only singly occupied sites, the weakly correlated state, where single and double occupation is allowed, and for the superconducting state, was determined for any value of XXX and any electron concentration n.n.n. At the half-filled band (n=1)(n=1)(n=1) a direct transition from the superconductor to the Mott insulator was found. In the region of strong correlations the superconducting solution is stable for nnn close to 1, in contrast to the case of weak correlations, in which superconductivity occurs at $n\ensuremath{\approx}0$ and $n\ensuremath{\approx}2.$ We have also found that strong correlations change the characteristics of the superconducting phase, e.g., the gap in the excitation spectrum exhibits a nonexponential dependence on the on-site Coulomb integral UUU close to the phase-transition point.
We theoretically analyze some of the anomalies of the optical sum rules in the high-temperature superconductors. In particular, we address the particularly strong dependence on temperature of the sum rule in the normal state. Both electron-electron correlations and the presence of a Van Hove singularity have been shown to enhance such a dependence. Here, we consider both effects simultaneously by means of dynamical mean-field theory for a two-dimensional Hubbard model with realistic parameters for different cuprates, and we find that the two effects are not cooperative, as they appear to compete with one another in the region of parameters relevant for the experiments.
We discuss the problem of a possible “violation” of the optical sum rule in the normal (nonsuperconducting) state of strongly correlated electronic systems, using our recently proposed DMFT + Σ approach applied to two typical models: the “hot spot” model of the pseudogap state and the disordered Anderson-Hubbard model. We explicitly demonstrate that the general Kubo single-band sum rule is satisfied for both models, but the optical integral itself is in general dependent on temperature and characteristic parameters, such as the pseudogap width, correlation strength, and disorder scattering, leading to an effective “violation” of the optical sum rule, which may be observed in experiments.