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DOE OSTI · 2479932

Fluctuating charge-density-wave correlations in the three-band Hubbard model

Abstract

The high-temperature superconducting cuprates host unidirectional spin- and charge-density-wave orders that can intertwine with superconductivity in nontrivial ways. While the charge components of these stripes have now been observed in nearly all cuprate families, their detailed evolution with doping varies across different materials and at high and low temperatures. We address this problem using nonperturbative determinant quantum Monte Carlo calculations for the three-band Hubbard model. Using an efficient implementation, we can resolve the model’s fluctuating spin and charge modulations and map their evolution as a function of the charge transfer energy and doping. We find that the incommensurability of the charge modulations is decoupled from the spin modulations and decreases with hole doping, consistent with experimental measurements at high temperatures. These findings support the proposal that the high-temperature charge correlations are distinct from the intertwined stripe order observed at low-temperature and in the single-band Hubbard model.

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Mai, Peizhi [University of Illinois at Urbana-Champaign, IL (United States)] (ORCID:0000000170214547), Cohen-Stead, Benjamin [University of Tennesse, Knoxville, TN (United States)] (ORCID:0000000279156280), Maier, Thomas A. [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)] (ORCID:0000000214249996), Johnston, Steven [University of Tennesse, Knoxville, TN (United States)] (ORCID:0000000223430113). 2024-12-05. Fluctuating charge-density-wave correlations in the three-band Hubbard model. https://doi.org/10.1073/pnas.2408717121

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