Quantitative assessment of the universal thermopower in the Hubbard model

Abstract As primarily an electronic observable, the room-temperature thermopower S in cuprates provides possibilities for a quantitative assessment of the Hubbard model. Using determinant quantum Monte Carlo, we demonstrate agreement between Hubbard model calculations and experimentally measured roo...

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Main Authors: Wen O. Wang, Jixun K. Ding, Edwin W. Huang, Brian Moritz, Thomas P. Devereaux
Format: Article
Language:English
Published: Nature Portfolio 2023-11-01
Series:Nature Communications
Online Access:https://doi.org/10.1038/s41467-023-42772-8
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author Wen O. Wang
Jixun K. Ding
Edwin W. Huang
Brian Moritz
Thomas P. Devereaux
author_facet Wen O. Wang
Jixun K. Ding
Edwin W. Huang
Brian Moritz
Thomas P. Devereaux
author_sort Wen O. Wang
collection DOAJ
description Abstract As primarily an electronic observable, the room-temperature thermopower S in cuprates provides possibilities for a quantitative assessment of the Hubbard model. Using determinant quantum Monte Carlo, we demonstrate agreement between Hubbard model calculations and experimentally measured room-temperature S across multiple cuprate families, both qualitatively in terms of the doping dependence and quantitatively in terms of magnitude. We observe an upturn in S with decreasing temperatures, which possesses a slope comparable to that observed experimentally in cuprates. From our calculations, the doping at which S changes sign occurs in close proximity to a vanishing temperature dependence of the chemical potential at fixed density. Our results emphasize the importance of interaction effects in the systematic assessment of the thermopower S in cuprates.
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spelling doaj.art-34f968b82a7c49868fb5197804698e162023-11-05T12:22:29ZengNature PortfolioNature Communications2041-17232023-11-011411610.1038/s41467-023-42772-8Quantitative assessment of the universal thermopower in the Hubbard modelWen O. Wang0Jixun K. Ding1Edwin W. Huang2Brian Moritz3Thomas P. Devereaux4Department of Applied Physics, Stanford UniversityDepartment of Applied Physics, Stanford UniversityDepartment of Physics and Institute of Condensed Matter Theory, University of Illinois at Urbana-ChampaignStanford Institute for Materials and Energy Sciences, SLAC National Accelerator LaboratoryStanford Institute for Materials and Energy Sciences, SLAC National Accelerator LaboratoryAbstract As primarily an electronic observable, the room-temperature thermopower S in cuprates provides possibilities for a quantitative assessment of the Hubbard model. Using determinant quantum Monte Carlo, we demonstrate agreement between Hubbard model calculations and experimentally measured room-temperature S across multiple cuprate families, both qualitatively in terms of the doping dependence and quantitatively in terms of magnitude. We observe an upturn in S with decreasing temperatures, which possesses a slope comparable to that observed experimentally in cuprates. From our calculations, the doping at which S changes sign occurs in close proximity to a vanishing temperature dependence of the chemical potential at fixed density. Our results emphasize the importance of interaction effects in the systematic assessment of the thermopower S in cuprates.https://doi.org/10.1038/s41467-023-42772-8
spellingShingle Wen O. Wang
Jixun K. Ding
Edwin W. Huang
Brian Moritz
Thomas P. Devereaux
Quantitative assessment of the universal thermopower in the Hubbard model
Nature Communications
title Quantitative assessment of the universal thermopower in the Hubbard model
title_full Quantitative assessment of the universal thermopower in the Hubbard model
title_fullStr Quantitative assessment of the universal thermopower in the Hubbard model
title_full_unstemmed Quantitative assessment of the universal thermopower in the Hubbard model
title_short Quantitative assessment of the universal thermopower in the Hubbard model
title_sort quantitative assessment of the universal thermopower in the hubbard model
url https://doi.org/10.1038/s41467-023-42772-8
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