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arXiv:0911.1180 · Physical Review B

Mechanism of formation of half-doped stripes in underdoped cuprates

Chung-Pin Chou, Ting-Kuo Lee

Published Feb 12, 2010• 27 citations
arXivHTMLPDF

Abstract

Using a variational Monte Carlo approach with a recently proposed stripe wave function, we showed that the strong correlation included in a $t\text{\ensuremath{-}}J$-type model has essentially all the necessary ingredients to form these stripes with modulations of charge density, spin magnetization, and pair field. If a perturbative effect of electron-phonon coupling to renormalize the effective mass or the hopping rate of holes is considered with the model, we find the half-doped stripes, which has on the average one half of a hole in one period of charge modulation, to be most stable energetic wise in the underdoped region, $1/12\ensuremath{\le}\ensuremath{\delta}\ensuremath{\le}1/8$. This is in good agreement with the observation in the neutron-scattering experiments. We also find long-range Coulomb interaction to be less effective in the formation of half-doped stripes.

DOI
10.1103/physrevb.81.060503

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Using a variational Monte Carlo approach with a recently proposed stripe wave function, we showed that the strong correlation included in a t\ensuremath-Jt\text{\ensuremath{-}}Jt\ensuremath-J-type model has essentially all the necessary ingredients to form these stripes with modulations of charge density, spin magnetization, and pair field. If a perturbative effect of electron-phonon coupling to renormalize the effective mass or the hopping rate of holes is considered with the model, we find the half-doped stripes, which has on the average one half of a hole in one period of charge modulation, to be most stable energetic wise in the underdoped region, 1/12\ensuremath≤\ensuremathδ\ensuremath≤1/81/12\ensuremath{\le}\ensuremath{\delta}\ensuremath{\le}1/81/12\ensuremath≤\ensuremathδ\ensuremath≤1/8. This is in good agreement with the observation in the neutron-scattering experiments. We also find long-range Coulomb interaction to be less effective in the formation of half-doped stripes.
We carry out the variational Monte Carlo calculation to examine spatially inhomogeneous states in hole- and electron-doped cuprates. By using Gutzwiller approximation, we consider the excitations, arising from charge density, spin density, and pair field, of the mean-field ground state of the ttt-JJJ model. It leads to the stripe patterns we have found numerically in a generalized ttt-JJJ-type model including mass renormalization from the electron-phonon coupling. In the hole-doped side, a robust ddd-wave superconducting order results in the formation of the half-doped antiferromagnetic resonating-valence-bond (AF-RVB) stripes shown by the well-known Yamada plot. On the other hand, due to a long-range AF order in electron-doped materials, a stripe structure with the ``in-phase'' magnetic domain (IPMD) is obtained in the underdoped regime instead of the AF-RVB stripe. The IPMD stripe with the largest period permitted by lattice size is stabilized near the underdoped region and it excludes the Yamada plot from electron-doped cases. Based on finite lattice size to which we can reach, the existence of IPMD stripes may imply an electronic phase separation into an electron-rich and an insulating half-filled AF long-range ordered domains in electron-doped compounds.
We carry out the variational Monte Carlo calculation to examine spatially inhomogeneous states in hole- and electron-doped cuprates. By using Gutzwiller approximation, we consider the excitations, arising from charge density, spin density and pair field, of the mean-field ground state of the t-J model. It leads to the stripe patterns we have found numerically in a generalized t-J-type model including mass renormalization from the electron-phonon coupling. In the hole-doped side, a robust d-wave superconducting order results in the formation of the half-doped antiferromagnetic resonating-valence-bond (AF-RVB) stripes shown by the well-known Yamada plot. On the other hand, due to a long-range AF order in electron-doped materials, a stripe structure with the "in-phase" magnetic domain (IPMD) is obtained in the underdoped regime instead of the AF-RVB stripe. The IPMD stripe with the largest period permitted by lattice size is stabilized near the underdoped region and it excludes the Yamada plot from electron-doped cases. Based on finite lattice size to which we can reach, the existence of IPMD stripes may imply an electronic phase separation into an electron-rich and an insulating half-filled AF long-range ordered domains in electron-doped compounds.
The dualism between superconductivity and charge/spin modulations (the so-called stripes) dominates the phase diagram of many strongly-correlated systems. A prominent example is given by the Hubbard model, where these phases compete and possibly coexist in a wide regime of electron dopings for both weak and strong couplings. Here, we investigate this antagonism within a variational approach that is based upon Jastrow-Slater wave functions, including backflow correlations, which can be treated within a quantum Monte Carlo procedure. We focus on clusters having a ladder geometry with M M legs (with M M ranging from 2 2 to 10 10 ) and a relatively large number of rungs, thus allowing us a detailed analysis in terms of the stripe length. We find that stripe order with periodicity \lambda=8 λ = 8 in the charge and 2\lambda=16 2 λ = 16 in the spin can be stabilized at doping \delta=1/8 δ = 1 / 8 . Here, there are no sizable superconducting correlations and the ground state has an insulating character. A similar situation, with \lambda=6 λ = 6 , appears at \delta=1/6 δ = 1 / 6 . Instead, for smaller values of dopings, stripes can be still stabilized, but they are weakly metallic at \delta=1/12 δ = 1 / 12 and metallic with strong superconducting correlations at \delta=1/10 δ = 1 / 10 , as well as for intermediate (incommensurate) dopings. Remarkably, we observe that spin modulation plays a major role in stripe formation, since it is crucial to obtain a stable striped state upon optimization. The relevance of our calculations for previous density-matrix renormalization group results and for the two-dimensional case is also discussed.
We have performed a variational Monte Carlo simulation on a two-dimensional Hubbard model with first- and second-neighbor hopping terms in order to study the coexistence state of a static stripe state and a modulated d-wave superconductivity in the underdoped cuprates. In addition to a Gutzwiller, a Jastrow and a doublon-holon correlation effects, the band-renormalization effect was considered in the trial wave function. The condensation energies of an 8-period stripe state was computed as a function of a Coulomb energy under the hole-density x=1/8. Our results reveal that the renormalization of higher hopping parameters due to the strong correlation effect enhances the one-dimensional hole motion on a quarter-filled band in the stripe state, and brings quasi-Fermi surface close to the magnetic zone boundary in the coexistence state.
Abstract Several state-of-the-art numerical methods have observed static or fluctuating spin and charge stripes in doped two-dimensional Hubbard models, suggesting that these orders play a significant role in shaping the cuprate phase diagram. Many experiments, however, also indicate that the cuprates have strong electron-phonon (e-ph) coupling, and it is unclear how this interaction influences stripe correlations. We study static and fluctuating stripe orders in the doped single-band Hubbard-Holstein model using zero temperature variational Monte Carlo and finite temperature determinant quantum Monte Carlo. We find that the lattice couples more strongly with the charge component of the stripes, leading to an enhancement or suppression of stripe correlations, depending on model parameters like the next-nearest-neighbor hopping t′{t}^{{\prime} }t′ t′ or phonon energy Ω. Our results help elucidate how thee-ph interaction can tip the delicate balance between stripe and superconducting correlations in the Hubbard-Holstein model with implications for our understanding of the high-Tccuprates.
While the stripe phase has been observed not only in monolayer cuprates but also in bilayer cuprates, research on its behavior in bilayer cuprates has been limited. Using constrained path quantum Monte Carlo, we explore the effect of stripes on the bilayer square lattice. We find the system exhibits short-range antiferromagnetism, which is enhanced by stripes and is strongest when the electron density of the interstriped rows reaches half-filling. The hole doping concentration plays a crucial role in the interaction between stripes and superconductivity. The ddd-wave pairing is enhanced by stripe potential V0{V}_{0}V0​ at the hole doping ${\ensuremath{\delta}}_{h}=1/4$, whereas it is suppressed by stripe potential V0{V}_{0}V0​ at the hole doping ${\ensuremath{\delta}}_{h}=1/8$. We elucidate this phenomenon through an analysis of the magnetism of the interstriped rows. Furthermore, the effective ddd-wave pairing is stronger in the bilayer model compared to the monolayer model when stripes are introduced on the square lattice. Overall, our unbiased numerical simulations provide a further understanding of the crossed bilayer square lattice model.