Intermediate bond-order-wave phase and nature of the order-to-order transition in the one-dimensional Hubbard-Holstein model

TL;DR

This study investigates the phase transitions in the one-dimensional Hubbard-Holstein model, revealing an intermediate bond-order-wave phase and characterizing the nature of the order-to-order transition using advanced quantum Monte Carlo simulations.

Contribution

The paper uncovers a narrow bond-order-wave phase in the 1D Hubbard-Holstein model and analyzes the order of phase transitions, employing an exact quantum Monte Carlo method for retarded interactions.

Findings

Discovery of a bond-order-wave phase emerging after the metallic regime

Identification of a second-order transition between charge orders

Transition becomes first-order at strong coupling

Abstract

The Hubbard-Holstein model is one of the central models that describe the competition between electron-electron and electron-phonon interactions. In one dimension and at half-filling, the interplay between an electronic spin-density wave and a phonon-driven charge-density wave is considered to stabilize an intermediate Luther-Emery liquid. Here we show that, once the extended metallic regime disappears, a narrow bond-order-wave phase emerges. We use an exact directed-loop quantum Monte Carlo method for retarded interactions to simulate system sizes of several hundred sites, necessary to observe the weak signatures of this novel phase. Our results suggest a second-order quantum phase transition between the two charge orders that only turns first-order at strong coupling. Our findings are reminiscent of the extended Hubbard model, but they are driven by competing frequency dependencies of the same dynamically-screened Hubbard interaction.