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Physica Scripta

Infrared threshold absorption in strongly correlated two-band superconductors

Vitaly S. Shumeiko, Lars Jönsson, Robert I Shekhter, Goran P. Wendin

Published Jan 1, 1992• 0 citations
Publisher

Abstract

Two-band models (one wide band and one narrow band close to the Fermi energy) and local-pair models (periodic Anderson model) of high- T c superconductors give rise to the same equilibrium thermodynamics despite the different physical pictures underlying the models. The low-energy excitations in these models are, however, not of the same character, which leads to a qualitative difference in their non-equilibrium properties. In particular, this is true for the interband optical absorption at threshold. Using the Golden rule for absorption and a mean-field treatment of the superconducting state, we calculate the threshold absorption at zero temperature for three different cases: a two-band model without additional correlation besides the interband interaction between Cooper pairs; a two-band model with attractive correlation (negative- U ) between electrons on the same site in the narrow band; and a local-pair model with the same correlation as in the previous model, but with a pair interaction due to the hybridization (in second order) of the wide band and the local states. In the two latter models (which are closely related), we assume that the local-pair correlation energy is much higher than T c . In the uncorrelated case the absorption has a square-root singularity at threshold, which is due to the diverging density of states of the one-particle excitations. In the negative- U correlated cases no single-particle transitions are possible at threshold, and only direct two-photon two-particle processes are possible. Further, in the local-pair model the hybridization can act together with a photon, giving an additional one-photon two-electron threshold in the absorption.

DOI
10.1088/0031-8949/1992/t42/016

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We study a generalized periodic Anderson model with on-site hybridization between wide- and narrow-band electrons and strong and local coupling with the lattice deformation. Provided that the interaction with the lattice is strong enough, the narrow-band electrons will be turned into small polarons which interact attractively with each other over short distances, leading to the formation of local pairs of narrow-band electrons. This leads to a pinning of the Fermi level which is due to the fact that narrow-band electrons exist only in pair states. By means of a generalized Schrieffer-Wolff transformation we eliminate hybridization and obtain an effective Hamiltonian which describes a contact interaction between local pairs and wide-band electrons as well as the direct hopping of local pairs and interparticle Coulomb interactions. In such a system the two types of mechanisms which can lead to superconductivity have been studied. The first one is due to direct local pair hopping and involves exclusively the narrow-band subsystem giving rise to a superconductivity analogous to superfluidity in 4He^{4}\mathrm{He}4He. The second one is due to a contact interaction between local pairs and pairs of wide-band electrons. This leads to a superconducting state involving both subsystems where the local pairs of the narrow-band subsystem induce Cooper pairing amongst the electrons of the wide-band subsystem. Consequently, the single-particle spectrum of the wide-band electrons opens up a gap around the position of the narrow band of electrons in pair states.We study the phase diagrams and the superconducting properties of two such coupled subsystems involving bosons and fermions as a function of the position of the narrow band with respect to the wide band (or the relative concentration of narrow and wide-band electrons). We also show that the critical temperature Tc{T}_{c}Tc​ and Tc{T}_{c}Tc​/Eg{E}_{g}Eg​(0) [Eg{E}_{g}Eg​(0) being the energy gap] follow, in general, a strong and nonmonotonic variation. One of the most striking features of this system is that the pairs of narrow-band electrons exist in the normal phase and condense on approaching Tc{T}_{c}Tc​ from above. The existence of such a narrow boson band together with a fermion band in the normal phase leads to characteristic behavior in the specific heat over temperature variation being very similar to that observed in recent studies of nonclassical superconductors.
By means of the exact-diagonalization method we have studied the finite-size two-band model with the interband pair-transfer interaction by calculating the superconducting (SC) correlation function P s etc. in the ground state. Occurrence of SC was clearly indicated by the increase of P s . The diagram of the observed SC region was constructed in the plane of the relative position of the second band versus on-site Coulomb energy U . In the low-density limit it proved close to the region where a negative- U situation is realized by the pair-transfer interaction. On the high-density side, the SC region was found to be more extended than the latter in accord with the previous interband-ladder-diagram results. Inclusion of the exchange interaction was found to reduce the SC region in a restricted region where two bands substantially share electrons. The two-band situations in cuprates are argued to be relevant to the high T c through the present mechanism.
On the basis of exact diagonalizations, a comparative study of two-particle optical and magnetic, as well as single-particle, excitations is presented for a two-dimensional (2D) multiorbital Hubbard model. For reasonable parameter sets appropriate for the cuprate superconductors, the single-particle excitations display strongly correlated states related to the Zhang-Rice Cu-O singlet construction. These states define the gap (to the upper Hubbard band) at half-filling and become partially occupied by doping holes in our 2\ifmmode\times\else\texttimes\fi{}2 unit-cell system. The optical results, which are the first quantitative calculations performed for realistic parameters of the three-band Hubbard model, clearly show three allowed optical transitions: (i) itinerant motion of the Cu-O singlets, having (for doping concentrations x\ensuremath{\ne}0) a spectral Drude distribution around \ensuremath{\omega}=0 with spectral weight proportional to x; (ii) unbinding of the O hole from the Cu spin in the singlet. This gives, in particular, a strong absorption peak due to singlet\ensuremath{\rightarrow}nonbonding oxygen transitions, again with relative weight \ensuremath{\sim}x.It is roughly centered at \ensuremath{\omega}\ensuremath{\sim}JKondo{\mathit{J}}_{\mathrm{Kondo}}JKondo​, where JKondo{\mathit{J}}_{\mathrm{Kondo}}JKondo​ is the Kondo coupling and \ensuremath{\Delta} the bare Cu-O charge-transfer energy. It is this singlet unbinding that results in the by far dominant absorption structure between Drude and higher-energy Cu-O transitions and not the often discussed ``mid-infrared'' absorption due to transitions between different singlet states. (iii) Cu-O charge-transfer processes at energy \ensuremath{\sim}\ensuremath{\Delta}+Upd{\mathit{U}}_{\mathit{p}\mathit{d}}Upd​. They show a pronounced excitonic effect due to the p-d interaction Upd{\mathit{U}}_{\mathit{p}\mathit{d}}Upd​ and have a reduced spectral weight shifted to higher energies for increased dopings. Findings (i)--(iii) are in general accordance with recent experimental data. Our study of the low-energy absorption is complemented with a numerical scaling analysis of the Drude weight in 1D, where, in particular, we find an interesting violation of Lenz's law for 4n-site Hubbard rings. Finally, the magnetic structure factor is calculated for the 2D case. For finite doping it contains a peak at 2JKondo{\mathit{J}}_{\mathrm{Kondo}}JKondo​, which should be detectable in experiment.
Studies of systems with two fermionic bands with repulsive interaction strength U have a long history, with the Periodic Anderson Model (PAM) being one of the most frequently considered Hamiltonians. In this paper, we use Quantum Monte Carlo to study analogous issues for attractive interactions. As in the Periodic Anderson Model, we focus on a case where one band is uncorrelated (U=0), and focus on the effect of hybridization V between the bands on the pairing correlations. A key difference with the PAM is that there is no sign problem, so that we are able to explore the physics of doped multi-band attractive systems at low temperatures whereas ground state properties of repulsive models can be determined only at half-filling. For small V, pairing in the U<0 layer induces pairing in the U=0 layer. At larger V the ground state of the coupled system loses its superconducting character. The Quantum Monte Carlo data are complemented by results obtained with the Bogoliubov-de Gennes approximation.
The pseudogap state of cuprate high-temperature superconductors has been often viewed as either a yet unknown competing order or a precursor state to superconductivity. While awaiting the resolution of the pseudogap problem in cuprates, we demonstrate that local pairing fluctuations, vortex liquid dynamics, and other precursor phenomena can emerge quite generally whenever fermionic excitations remain gapped across the superconducting transition, regardless of the gap origin. Our choice of a tractable model is a lattice band insulator with short-range attractive interactions between fermions in the sss-wave channel. An effective crossover between Bardeen-Cooper-Schrieffer (BCS) and Bose-Einstein condensate (BEC) regimes can be identified in any band insulator above two dimensions, while in two dimensions only the BEC regime exists. The superconducting transition is ``unconventional'' (non-pair-breaking) in the BEC regime, identified by either the bosonic mean field or XY\mathit{XY}XY universality class. The insulator adjacent to the superconductor in the BEC regime is a bosonic Mott insulator of Cooper pairs, which may be susceptible to charge density wave ordering. We construct a function of the many-body excitation spectrum whose nonanalytic changes define a sharp distinction between band and Mott insulators. The corresponding ``second-order transition'' can be observed out of equilibrium by driving a Cooper pair laser in the Mott insulator. We explicitly show that the gap for charged bosonic excitations lies below the threshold for Cooper pair breakup in any BEC regime, despite quantum fluctuations. Our discussion ends with a view of possible consequences for cuprates, where antinodal pair dynamics has certain features in common with our simple sss-wave picture.