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arXiv:2409.18833

Pair density wave, infinite-length stripes, and holon Wigner crystal in single-band Hubbard model on diagonal square lattice

Zhiyi Xu, Gui-Xin Liu, Yi‐Fan Jiang

Published Sep 27, 2024• 0 citations
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Abstract

We employ large-scale density-matrix renormalization group (DMRG) simulations to investigate the quantum phase diagram of the hole-doped Hubbard model on square lattices. By implementing a diagonally oriented square lattice and GPU-accelerated DMRG with up to $48000$ states, we identify three distinct quantum phases across $δ= 5\%$ to $15\%$ doping: (i) A diagonal stripe phase with short-range uniform superconductivity (SC) at lower doping $δ\lesssim 9\%$; (ii) An intermediate holon Wigner crystal (WC*) phase exhibiting bidirectional charge-density order and short-range SC with spatial oscillating correlations; (iii) An unprecedented infinite-length stripe (i-stripe) phase at $δ\gtrsim 12\%$ hosting long stripes spanning the whole lattice. Remarkably, as doping increases, the short-range SC in WC* phase evolves into a 2D-like pair density wave (PDW) with divergent susceptibility in the i-stripe phase, constituting probably the first controlled numerical evidence of dominant PDW in the single-band square-lattice Hubbard model. The established 2D-like PDW and its interplay with charge orders provide new perspectives on dynamical layer decoupling phenomena in cuprates and multifaceted relationships between charge, spin and SC orders in quantum materials.

DOI
10.48550/arxiv.2409.18833

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We employ large-scale density-matrix renormalization group (DMRG) simulations to investigate the quantum phase diagram of the hole-doped Hubbard model on square lattices. By implementing a diagonally oriented square lattice and GPU-accelerated DMRG with up to 480004800048000 states, we identify three distinct quantum phases across δ=5%δ= 5\%δ=5% to 15%15\%15% doping: (i) A diagonal stripe phase with short-range uniform superconductivity (SC) at lower doping δ≲9%δ\lesssim 9\%δ≲9%; (ii) An intermediate holon Wigner crystal (WC*) phase exhibiting bidirectional charge-density order and short-range SC with spatial oscillating correlations; (iii) An unprecedented infinite-length stripe (i-stripe) phase at δ≳12%δ\gtrsim 12\%δ≳12% hosting long stripes spanning the whole lattice. Remarkably, as doping increases, the short-range SC in WC* phase evolves into a 2D-like pair density wave (PDW) with divergent susceptibility in the i-stripe phase, constituting probably the first controlled numerical evidence of dominant PDW in the single-band square-lattice Hubbard model. The established 2D-like PDW and its interplay with charge orders provide new perspectives on dynamical layer decoupling phenomena in cuprates and multifaceted relationships between charge, spin and SC orders in quantum materials.
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The square-lattice Hubbard and closely related t-J models are considered as basic paradigms for understanding strong correlation effects and unconventional superconductivity (SC). Recent large-scale density matrix renormalization group simulations on the extended t-J model have identified d-wave SC on the electron-doped side (with the next-nearest-neighbor hopping t_{2}>0) but a dominant charge density wave (CDW) order on the hole-doped side (t_{2}<0), which is inconsistent with the SC of hole-doped cuprate compounds. We re-examine the ground-state phase diagram of the extended t-J model by employing the state-of-the-art density matrix renormalization group calculations with much enhanced bond dimensions, allowing more accurate determination of the ground state. On six-leg cylinders, while different CDW phases are identified on the hole-doped side for the doping range δ=1/16-1/8, a SC phase emerges at a lower doping regime, with algebraically decaying pairing correlations and d-wave symmetry. On the wider eight-leg systems, the d-wave SC also emerges on the hole-doped side at the optimal 1/8 doping, demonstrating the winning of SC over CDW by increasing the system width. Our results not only suggest a new path to SC in general t-J model through weakening the competing charge orders, but also provide a unified understanding on the SC of both hole- and electron-doped cuprate superconductors.
The authors employ the density-matrix renormalization group to investigate the doped Hubbard model on six-leg square cylinders. It uncovers a rich quantum phase diagram, intricately sensitive to next-nearest-neighbor electron hopping ($t\ensuremath{'}$). The positive-ttt\ensuremath{'} region shows a robust ddd-wave superconducting phase with intertwined superconducting and charge-density-wave orders. In contrast, the negative-ttt\ensuremath{'} side remains insulating, where doped holes form either long-range charge stripe order at small ttt\ensuremath{'} or a holon Wigner crystal with one doped hole per emergent unit cell and short-range spin correlations at larger ttt'.
Recently, a flurry of works have found strong competition between charge density wave (CDW) and superconductivity (SC) in the doped Hubbard and $t\text{\ensuremath{-}}J$ models on the square lattice. Interestingly, some recent results suggest that the electron-phonon coupling may suppress CDW order and enhance SC. In this work, we consider the square-lattice Hubbard model with the Holstein or Su-Schrieffer-Heeger electron-phonon coupling at the large-UUU and antiadiabatic (infinite phonon frequency) limits, which gives an effective $t\text{\ensuremath{-}}J$ model with either a density attractive interaction VVV or a JP{J}_{P}JP​ term that contributes a larger spin exchange and a density repulsive interaction. To explore how these effective couplings may tune the competition between CDW and SC, we implement the density matrix renormalization group simulations on the $t\text{\ensuremath{-}}{t}^{\ensuremath{'}}\text{\ensuremath{-}}J$ model with VVV or JP{J}_{P}JP​ coupling. We focus on the six-leg cylinder system with the next-nearest-neighbor hopping ${t}^{\ensuremath{'}}$, which hosts partially filled stripe and ddd-wave SC in phase diagram. By tuning ${t}^{\ensuremath{'}}/t>0$ and VVV or JP{J}_{P}JP​, we establish two quantum phase diagrams at 112\frac{1}{12}121​ doping ratio. In the SC phases, the increased VVV or JP{J}_{P}JP​ coupling can enhance the quasi-long-range SC order, consistent with some previous findings. Nonetheless, no SC emerges when the partially filled stripe phase disappears with increased VVV or JP{J}_{P}JP​. Instead, the system has a transition to either a phase-separation-like regime or a filled stripe phase. On the other hand, with increased ${t}^{\ensuremath{'}}/t$, not only the partially filled stripe but the phase separation and filled stripe can also be tuned to SC phase. Our results suggest that although VVV and JP{J}_{P}JP​ couplings may strengthen hole binding, the hole dynamics controlled by ${t}^{\ensuremath{'}}/t$ appears to play a more crucial role for obtaining a SC in the $t\text{\ensuremath{-}}J$ model.
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