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arXiv:1708.06749 · Physical review. B./Physical review. B

Dynamical mean-field theory study of stripe order and d -wave superconductivity in the two-dimensional Hubbard model

Tuomas I. Vanhala, Päivi Törmä

Published Feb 7, 2018• 36 citations
arXivHTMLPDF

Abstract

We use cellular dynamical mean-field theory with extended unit cells to study the ground state of the two-dimensional repulsive Hubbard model at finite doping. We calculate the energy of states where $d$-wave superconductivity coexists with spatially nonuniform magnetic and charge order and find that they are energetically favored in a large doping region as compared to the uniform solution. We also study the spatial form of the density and the superconducting and magnetic order parameters at different doping values.

DOI
10.1103/physrevb.97.075112

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We use cellular dynamical mean-field theory with extended unit cells to study the ground state of the two-dimensional repulsive Hubbard model at finite doping. We calculate the energy of states where ddd-wave superconductivity coexists with spatially nonuniform magnetic and charge order and find that they are energetically favored in a large doping region as compared to the uniform solution. We also study the spatial form of the density and the superconducting and magnetic order parameters at different doping values.
We perform a renormalized mean-field study of the two-dimensional repulsive Hubbard model, focusing on the intricate interplay and possible coexistence of magnetic, charge, and superconducting orders. We improve on conventional mean-field theory by utilizing a renormalization group framework that captures high-energy fluctuations. This method generates effective magnetic and d -wave pairing interactions, and allows for an unbiased exploration of coexisting phases at weak and moderate interaction strengths. Unrestricted mean-field calculations of the effective Hamiltonian on large finite lattices are combined with analyses in the thermodynamic limit, revealing a rich phase diagram with extensive regions of coexisting orders. We find that d -wave superconductivity coexists with Néel order on the electron-doped side. On the hole-doped side, superconductivity is found to coexist with spiral or stripe magnetic orders. Within the stripe-ordered region, the superconducting order parameter is spatially modulated, with a period that follows the charge modulation of the stripes. Below Van Hove filling, pairing provides the primary energy gain, while the stripe order yields only a small, and hence fragile, additional energy lowering.
Applying the dynamical mean-field theory to the two-dimensional Hubbard model, we calculate self-consistent solutions of doped antiferromagnets with spatially varying spin density ‹ n iσ › using realistic tight-binding parameters. The local self-energy of the supercell includes transverse and longitudinal spin fluctuations with an effective local potential due to short-range electron-electron correlations. It is found that metallic stripes are stabilized by a pseudogap. The stripes along (1,0) direction filled by one hole per two-domain wall unit cells change with increasing Coulomb interaction U to the more extended stripes along (1,1) direction consisting of four atoms filled by 1/4 doped hole each. These findings agree qualitatively with the experimental observations in the superconducting cuprates, and predict a qualitative difference between various compounds due to differences in the extended hopping parameters. These keywords were added by machine and not by the authors. This process is experimental and the keywords may be updated as the learning algorithm improves.
We study the competition between stripe states with different periods and a uniform ddd-wave superconducting state in the extended two-dimensional Hubbard model at 1/8 hole doping using infinite projected entangled-pair states (iPEPS). With increasing strength of negative next-nearest neighbor hopping ${t}^{\ensuremath{'}}$, the preferred period of the stripe decreases. For the values of ${t}^{\ensuremath{'}}$ predicted for cuprate high-Tc{T}_{c}Tc​ superconductors, we find stripes with a period 4 in the charge order, in agreement with experiments. Superconductivity in the period 4 stripe is suppressed at 1/81/81/8 doping. Only at larger doping, $0.18\ensuremath{\lesssim}\ensuremath{\delta}<0.25$, the period 4 stripe exhibits coexisting ddd-wave superconducting order. The uniform ddd-wave state is only favored for sufficiently large positive ${t}^{\ensuremath{'}}$.
The two-dimensional Hubbard model was originally proposed as the minimal model of uniform ddd-wave superconductivity in the cuprate high-temperature superconductors, but recent calculations with relevant parameters in a realistic doping regime have often found other ground states. Further, uncertainty remains over such results due to the intrinsic bias of different computational methods. Here we address this uncertainty through state-of-the-art neural tensor network and neural backflow state simulations, enabled by large-scale GPU computation, that together reach an unprecedented variational accuracy on lattices with up to 1024 sites. At 1/81/81/8 doping in the pure Hubbard model, as well as with next-nearest-neighbor hopping relevant to the hole-doped cuprates, we reveal a near degeneracy among a low-energy uniform ddd-wave state, superconducting stripes, and non-superconducting stripe states on the milli-ttt energy scale. Our work rebalances the narrative that the Hubbard model supports a single dominant order in relevant parameter regimes towards a picture of extreme competition between stripes and superconductivity.
We determine the spin and charge orders in the ground state of the doped two-dimensional (2D) Hubbard model in its simplest form, namely with only nearest-neighbor hopping and on-site repulsion. At half-filling, the ground state is known to be an antiferromagnetic Mott insulator. Doping Mott insulators is believed to be relevant to the superconductivity observed in cuprates. A variety of candidates have been proposed for the ground state of the doped 2D Hubbard model. A recent work employing a combination of several state-of-the-art numerical many-body methods established the stripe order as the ground state near 1/81/81/8 doping at strong interactions. In this paper, we apply one of these methods, the cutting-edge constrained-path auxiliary field quantum Monte Carlo (AFQMC) method with self-consistently optimized gauge constraints, to systematically study the model as a function of doping and interaction strength. With careful finite size scaling based on large-scale computations, we map out the ground state phase diagram in terms of its spin and charge order. We find that modulated antiferromagnetic order persists from near half-filling to about 1/51/51/5 doping. At lower interaction strengths or larger doping, these ordered states are best described as spin-density waves, with essentially delocalized holes and modest oscillations in charge correlations. When the charge correlations are stronger (large interaction or small doping), they are best described as stripe states, with the holes more localized near the node in the antiferromagnetic spin order. In both cases, we find that the wavelength in the charge correlations is consistent with so-called filled stripes.
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.