Langevin simulations of the half-filled cubic Holstein model
Abstract
Over the past several years, reliable quantum Monte Carlo results for the charge density wave transition temperature Tcdw of the half-filled two-dimensional Holstein model in square and honeycomb lattices have become available for the first time. Here, exploiting the further development of numerical methodology, here we present results in three dimensions, which are made possible through the use of Langevin evolution of the quantum phonon degrees of freedom. In addition to determining Tcdw from the scaling of the charge correlations, we also examine the nature of charge order at general wave vectors for different temperatures, couplings, and phonon frequencies, and the behavior of the spectral function and specific heat.
- Authors:
-
- Univ. of California, Davis, CA (United States)
- Los Alamos National Lab. (LANL), Los Alamos, NM (United States)
- Chinese Academy of Sciences (CAS), Beijing (China); Univ. of Hong Kong (China); Songshan Lake Materials Lab., Guangdong (China)
- Chinese Academy of Sciences (CAS), Beijing (China)
- Univ. Côte d'Azur, Nice (France); National Univ. of Singapore (Singapore); Beijing Computational Science Research Center (China)
- Publication Date:
- Research Org.:
- Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC)
- OSTI Identifier:
- 1844141
- Report Number(s):
- LA-UR-20-24119
Journal ID: ISSN 2469-9950; TRN: US2302345
- Grant/Contract Number:
- 89233218CNA000001; SC0014671
- Resource Type:
- Accepted Manuscript
- Journal Name:
- Physical Review. B
- Additional Journal Information:
- Journal Volume: 102; Journal Issue: 16; Journal ID: ISSN 2469-9950
- Publisher:
- American Physical Society (APS)
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 75 CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY; Material science; Charge density waves; Electron-phonon coupling; Holstein model; Langevin algorithm; Quantum Monte Carlo
Citation Formats
Cohen-Stead, B., Barros, Kipton, Meng, ZY, Chen, Chuang, Scalettar, R. T., and Batrouni, G. G. Langevin simulations of the half-filled cubic Holstein model. United States: N. p., 2020.
Web. doi:10.1103/physrevb.102.161108.
Cohen-Stead, B., Barros, Kipton, Meng, ZY, Chen, Chuang, Scalettar, R. T., & Batrouni, G. G. Langevin simulations of the half-filled cubic Holstein model. United States. https://doi.org/10.1103/physrevb.102.161108
Cohen-Stead, B., Barros, Kipton, Meng, ZY, Chen, Chuang, Scalettar, R. T., and Batrouni, G. G. Tue .
"Langevin simulations of the half-filled cubic Holstein model". United States. https://doi.org/10.1103/physrevb.102.161108. https://www.osti.gov/servlets/purl/1844141.
@article{osti_1844141,
title = {Langevin simulations of the half-filled cubic Holstein model},
author = {Cohen-Stead, B. and Barros, Kipton and Meng, ZY and Chen, Chuang and Scalettar, R. T. and Batrouni, G. G.},
abstractNote = {Over the past several years, reliable quantum Monte Carlo results for the charge density wave transition temperature Tcdw of the half-filled two-dimensional Holstein model in square and honeycomb lattices have become available for the first time. Here, exploiting the further development of numerical methodology, here we present results in three dimensions, which are made possible through the use of Langevin evolution of the quantum phonon degrees of freedom. In addition to determining Tcdw from the scaling of the charge correlations, we also examine the nature of charge order at general wave vectors for different temperatures, couplings, and phonon frequencies, and the behavior of the spectral function and specific heat.},
doi = {10.1103/physrevb.102.161108},
journal = {Physical Review. B},
number = 16,
volume = 102,
place = {United States},
year = {Tue Oct 13 00:00:00 EDT 2020},
month = {Tue Oct 13 00:00:00 EDT 2020}
}
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