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Charge ordering in extended Hubbard models: Variational cluster approach

2004/02/24 by Markus Aichhorn, M. Aichhorn, H. G. Evertz +5
Physics and Astronomy · #Advanced Condensed Matter Physics #Physics of Superconductivity and Magnetism #Quantum and electron transport phenomena #cond-mat.str-el

paper · pdf · doi:10.1103/physrevb.70.235107

published as PRB 70, 235107 (2004) · 15 pages, 12 figures

arxiv created 2004/02/24 · openalex publication_date 2004/12/03 · arxiv updated 2009/12/01 · openalex created_date 2025/10/10 · openalex updated_date 2026/07/28

Abstract

We present a generalization of the recently proposed variational cluster perturbation theory to extended Hubbard models at half-filling with repulsive nearest neighbor interaction. The method takes into account short-range correlations correctly by the exact diagonalization of clusters of finite size, whereas long-range order beyond the size of the clusters is treated on a mean-field level. For one dimension, we show that quantum Monte Carlo and density-matrix renormalization-group results can be reproduced with very good accuracy. Moreover we apply the method to the two-dimensional extended Hubbard model on a square lattice. In contrast to the one-dimensional case, a first order phase transition between spin density wave phase and charge density wave phase is found as function of the nearest-neighbor interaction at onsite interactions U\ensuremath\geqslant3t. The single-particle spectral function is calculated for both the one-dimensional and the two-dimensional system.

Citations