Work

Charge ordering and correlation effects in the extended Hubbard model

Year: 2017
Type: article
Abstract: We study the half-filled extended Hubbard model on a two-dimensional square lattice using cluster dynamical mean-field theory on clusters of size 8--20. We show that the model exhibits metallic, Mott-insulating, and charge-ordered phases, and determine the location of the charge-ordering phase-transition line and the properties of the phases as a function of temperature, local interaction, and nearest-neighbor interaction. We find strong nonlocal correlations outside the charge-ordered phase and a pronounced screening effect in the vicinity of the phase transition, where nonlocal interactions push the system towards metallic behavior. In contrast, correlations in the charge-ordered phase are mostly local to the unit cell. Finally, we demonstrate how strong nonlocal electron-electron interactions can increase electron mobility by turning a charge-ordered insulator into a metal. We analyze finite-size effects and the convergence of our data to the thermodynamic limit. Control of all sources of errors allows us to assess the regime of applicability of simpler approximation schemes for systems with nonlocal interactions.
Language: English
Open Access status: green
OpenAlex ID: W2554872430
FWCI: 5.211
Cites: 100
Cited by: 71
Related to: 10