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arXiv:1104.5540 · Physical Review B

d -wave superconductivity on the checkerboard Hubbard model at weak and strong coupling

Shiladitya Chakraborty, David Sénéchal, A.–M. S. Tremblay

Published Aug 26, 2011• 14 citations
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Abstract

It has been argued that inhomogeneity generally can enhance superconductivity (SC) in the cuprate high-${T}_{c}$ materials. To check the validity of this claim, we study $d$-wave SC on the checkerboard Hubbard model on a square lattice using the cellular dynamical mean-field theory method with an exact diagonalization solver at zero temperature. The $d$-wave order parameter is computed for various inhomogeneity levels over the entire doping range of interest in both strong- and weak-coupling regimes. At a given doping, the size of the $d$-wave order parameter manifests itself directly in the height of the coherence peaks and, hence, is an appropriate measure of the strength of SC. The weak-coupling results reveal a suppression of the order parameter in the presence of inhomogeneity for small-to-intermediate hole dopings, while it is enhanced for large dopings. In contrast, for strong coupling, there is a monotonic decrease in the maximum amplitude of the SC order parameter with inhomogeneity over the entire doping range of interest. Furthermore, at moderately high inhomogeneity, the system undergoes a first-order transition from the SC to the normal state in the underdoped regime. In the overdoped regime, the change in the value of the SC order parameter correlates with the height of the lowest-energy peak in the spectral weight of antiferromagnetic spin fluctuations, confirming the connection between antiferromagnetic fluctuations and $d$-wave SC found in earlier papers on the homogeneous case. Our results are benchmarked by comparisons with numerically exact results on the checkerboard Hubbard ladder.

DOI
10.1103/physrevb.84.054545

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It has been argued that inhomogeneity generally can enhance superconductivity (SC) in the cuprate high-Tc{T}_{c}Tc​ materials. To check the validity of this claim, we study ddd-wave SC on the checkerboard Hubbard model on a square lattice using the cellular dynamical mean-field theory method with an exact diagonalization solver at zero temperature. The ddd-wave order parameter is computed for various inhomogeneity levels over the entire doping range of interest in both strong- and weak-coupling regimes. At a given doping, the size of the ddd-wave order parameter manifests itself directly in the height of the coherence peaks and, hence, is an appropriate measure of the strength of SC. The weak-coupling results reveal a suppression of the order parameter in the presence of inhomogeneity for small-to-intermediate hole dopings, while it is enhanced for large dopings. In contrast, for strong coupling, there is a monotonic decrease in the maximum amplitude of the SC order parameter with inhomogeneity over the entire doping range of interest. Furthermore, at moderately high inhomogeneity, the system undergoes a first-order transition from the SC to the normal state in the underdoped regime. In the overdoped regime, the change in the value of the SC order parameter correlates with the height of the lowest-energy peak in the spectral weight of antiferromagnetic spin fluctuations, confirming the connection between antiferromagnetic fluctuations and ddd-wave SC found in earlier papers on the homogeneous case. Our results are benchmarked by comparisons with numerically exact results on the checkerboard Hubbard ladder.
Proximity to a Mott insulating phase is likely to be an important physical ingredient of a theory that aims to describe high-temperature superconductivity in the cuprates. Quantum cluster methods are well suited to describe the Mott phase. Hence, as a step toward a quantitative theory of the competition between antiferromagnetism and ddd-wave superconductivity in the cuprates, we use cellular dynamical mean-field theory to compute zero-temperature properties of the two-dimensional square lattice Hubbard model. The ddd-wave order parameter is found to scale like the superexchange coupling JJJ for on-site interaction UUU comparable to or larger than the bandwidth. The order parameter also assumes a dome shape as a function of doping, while, by contrast, the gap in the single-particle density of states decreases monotonically with increasing doping. In the presence of a finite second neighbor hopping ${t}^{\ensuremath{'}}$, the zero-temperature phase diagram displays the electron-hole asymmetric competition between antiferromagnetism and superconductivity that is observed experimentally in the cuprates. Adding realistic third neighbor hopping ${t}^{\ensuremath{''}}$ improves the overall agreement with the experimental phase diagram. Since band parameters can vary depending on the specific cuprate considered, the sensitivity of the theoretical phase diagram to band parameters challenges the commonly held assumption that the doping vs Tc∕Tcmax{T}_{c}∕{T}_{c}^{\mathit{max}}Tc​∕Tcmax​ phase diagram of the cuprates is universal. The calculated angle-resolved photoemission spectrum displays the observed electron-hole asymmetry. The tendency to homogeneous coexistence of the superconducting and antiferromagnetic order parameters is stronger than observed in most experiments but consistent with many theoretical results and with experiments in some layered high-temperature superconductors. Clearly, our calculations reproduce important features of ddd-wave superconductivity in the cuprates that would otherwise be considered anomalous from the point of view of the standard Bardeen--Cooper--Schrieffer approach. At strong coupling, ddd-wave superconductivity and antiferromagnetism naturally appear as two equally important competing instabilities of the normal phase of the same underlying Hamiltonian.
We study the competition of antiferromagnetism and ddd-wave superconductivity at zero temperature in the two-dimensional Hubbard model using cellular dynamical mean-field theory for a $2\ifmmode\times\else\texttimes\fi{}2$ plaquette, and solve the associated cluster impurity model at zero temperature by means of exact diagonalization. The interplay between the two phases depends strongly on the strength of the correlation. At strong coupling $(U\ensuremath{\gtrsim}8t)$ the two phases do not mix, and a first-order transition takes place as a function of doping between two pure phases. At weak coupling $(U\ensuremath{\lesssim}8t)$ the two order parameters coexist within the same solution in a range of doping and the system smoothly evolves from the antiferromagnet to the superconductor. When the transition between the superconducting and the antiferromagetic phases is of the first-order, it is accompanied by a phase separation.
With the high-Tc cuprates in mind, properties of correlated d-wave superconducting (SC) states are studied for a Hubbard model on square lattices with a diagonal transfer (t-t’-U model), using a variational Monte Carlo method. We employ a simple wave function, which includes crucial parameters, in particular, a doublon-holon (D-H) binding factor important for correlated SC and normal states as doped Mott insulators. We first check that the range of dominant superconductivity is limited to a strongly correlated regime (U>W, U: onsite correlation strength, W: band width), and coincides with the effective range of the D-H binding factors. In this range of U/t and δ (doping rate), holons (in hole-doped cases) are classified into two types: doped holons and ones created as D-H pairs. Only the former holons participate in current, whereas the latter contribute to singlet-pair formation. Next, we show that the SC properties undergo a crossover at U=Uco∼W. For U<Uco, the behavior is appropriately interpreted with the conventional BCS mechanism, whereas for U>Uco (the regime of cuprates), a new idea is needed to understand the peculiar SC behavior.
We study the square-lattice extended Hubbard model with on-site UUU and nearest-neighbor VVV interactions by exact diagonalization. We show that nonequilibrium quench dynamics can help determine the equilibrium phase transition boundaries, which agree with the calculations of the fidelity metric, dynamical structure factor, and correlation function. At half filling, the phase diagrams in the strong-coupling regime include spin density wave and ${d}_{{x}^{2}\ensuremath{-}{y}^{2}}$-wave superconductivity at large positive UUU, charge density wave (extended s∗{s}^{*}s∗-wave superconductivity) at large positive (negative) VVV, and sss-wave superconductivity at large negative UUU with vanishing VVV. The energies of different particle sectors also help determine the phase separation region. With carrier doping, charge fluctuation results in a strong competition between different orders, making it more difficult to identify the leading instability on finite-size clusters. Nevertheless, the more exotic ppp-wave superconducting pairing is found to be enhanced when the system is heavily overdoped by 37.537.5%--50%37.5 holes, especially in the interaction parameter range relevant to the cuprate superconductors.
Motivated by the recent discovery of anomalously strong nearest-neighbor attraction in the one-dimensional hole-doped cuprate ${\text{Ba}}_{2+x}{\text{Sr}}_{x}{\text{CuO}}_{3+\ensuremath{\delta}}$, we investigate the ddd-wave superconducting property of an extended checkerboard Hubbard model, which includes an intraplaquette nearest-neighbor attraction VVV. Our quantum Monte Carlo simulations reveal that, for small interplaquette hopping integral ${t}^{\ensuremath{'}}$, VVV induces a drastic enhancement of long-range ddd-wave pairing correlations in the parameter range of $0.0\ensuremath{\le}U\ensuremath{\le}6.0t$ (ttt is the intraplaquette hopping integral) when the electron density lies between half-filling and quarter-filling. At $V=\ensuremath{-}0.4t$, one order of magnitude larger ddd-wave pairing correlations are observed compared to the ones at V=0.0tV=0.0tV=0.0t and, more importantly, they exceed the values of the free electron system, signifying the existence of ddd-wave superconductivity. The exact diagonalization calculations on the $2\ifmmode\times\else\texttimes\fi{}2$ plaquette indicate that the enhancement of ddd-wave pairing correlations can be attributed to the VVV-induced enhancement of pair-binding energy. Our findings provide a new perspective on the realization of high-temperature ddd-wave superconductivity via the combination of nearest-neighbor attraction and electronic inhomogeneity.
Using a dynamical cluster quantum Monte Carlo approximation, we investigate the ddd-wave superconducting transition temperature Tc{T}_{c}Tc​ in the doped two-dimensional repulsive Hubbard model with a weak inhomogeneity. The inhomogeneity is introduced in the hoppings ${t}^{\ensuremath{'}}$ and ttt in the form of a checkerboard pattern where ttt is the hopping within a $2\ifmmode\times\else\texttimes\fi{}2$ plaquette, and ${t}^{\ensuremath{'}}$ is the hopping between the plaquettes. We find inhomogeneity suppresses Tc{T}_{c}Tc​. The characteristic spin excitation energy and the strength of ddd-wave pairing interaction decrease with decreasing Tc{T}_{c}Tc​, suggesting a strong correlation between these quantities.