Phase competition in a one-dimensional three-orbital Hubbard-Holstein model

Liu, Shaozhi; Tang, Yanfei; Maier, Thomas A.; Johnston, Steven

doi:10.1103/PhysRevB.97.195116

Phase competition in a one-dimensional three-orbital Hubbard-Holstein model

Journal Article · Thu May 10 00:00:00 EDT 2018 · Physical Review B

DOI:https://doi.org/10.1103/PhysRevB.97.195116· OSTI ID:1474640

Liu, Shaozhi ^[1]; Tang, Yanfei ^[2]; ^[3]; Johnston, Steven ^[4]

Univ. of Tennessee, Knoxville, TN (United States). Department of Physics and Astronomy
Virginia Tech, Blacksburg, VA (United States). Department of Physics
Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States). Center for Nanophase Materials Science (CNMS) and Computational Sciences and Engineering Division
Univ. of Tennessee, Knoxville, TN (United States). Department of Physics and Astronomy and Joint Institute of Advanced Materials

Here, we study the interplay between the electron-phonon (e-ph) and on-site electron-electron (e-e) interactions in a three-orbital Hubbard-Holstein model on an extended one-dimensional lattice using determinant quantum Monte Carlo. For weak e-e and e-ph interactions, we observe a competition between an orbital-selective Mott phase (OSMP) and a (multicomponent) charge-density-wave (CDW) insulating phase, with an intermediate metallic phase located between them. Additionally, for large e-e and e-ph couplings, the OSMP and CDW phases persist, while the metallic phase develops short-range orbital correlations and becomes insulating when both the e-e and e-ph interactions are large but comparable. Many of our conclusions are in line with those drawn from a prior dynamical mean-field theory study of the two-orbital Hubbard-Holstein model [Phys. Rev. B 95, 121112(R) (2017)] in infinite dimension, suggesting that the competition between the e-ph and e-e interactions in multiorbital Hubbard-Holstein models leads to rich physics, regardless of the dimension of the system.

View Accepted Manuscript (DOE)

Research Organization:: Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Advanced Scientific Computing Research (ASCR) (SC-21); USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22). Materials Sciences & Engineering Division

Grant/Contract Number:: AC05-00OR22725

OSTI ID:: 1474640

Alternate ID(s):: OSTI ID: 1436823

Journal Information:: Physical Review B, Journal Name: Physical Review B Journal Issue: 19 Vol. 97; ISSN 2469-9950; ISSN PRBMDO

Publisher:: American Physical Society (APS)Copyright Statement

Country of Publication:: United States

Language:: English

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