Hybrid Monte Carlo study of monolayer graphene with partially screened Coulomb interactions at finite spin density

Michael Körner, Dominik Smith, Pavel Buividovich, Maksim Ulybyshev, and Lorenz von Smekal
Phys. Rev. B 96, 195408 – Published 6 November 2017

Abstract

We report on Hybrid Monte Carlo simulations at finite spin density of the π-band electrons in monolayer graphene with realistic interelectron interactions. Unlike simulations at finite charge-carrier density, these are not affected by a fermion-sign problem. Our results are in qualitative agreement with an interaction-induced warping of the Fermi contours and a reduction of the bandwidth as observed in angle-resolved photoemission spectroscopy experiments on charge-doped graphene systems. Furthermore, we find evidence that the neck-disrupting Lifshitz transition, which occurs when the Fermi level traverses the van Hove singularity (VHS), becomes a true quantum phase transition due to interactions. This is in line with an instability of the VHS toward the formation of ordered electronic phases, which has been predicted by a variety of different theoretical approaches.

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  • Received 13 April 2017
  • Revised 8 September 2017

DOI:https://doi.org/10.1103/PhysRevB.96.195408

©2017 American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Michael Körner1, Dominik Smith1, Pavel Buividovich2, Maksim Ulybyshev2, and Lorenz von Smekal1

  • 1Institut für Theoretische Physik, Justus-Liebig-Universität, 35392 Giessen, Germany
  • 2Institut für Theoretische Physik, Universität Regensburg, 93053 Regensburg, Germany

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Issue

Vol. 96, Iss. 19 — 15 November 2017

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