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A Study of the Effects of Disorder in the 2D Hubbard Model

Matthew Enjalran, F. Hébert, Richard T. Scalettar, S. Zhang, G. G. Batrouni

Published Jun 5, 2000• 0 citations
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Abstract

We study the effects of disorder on long range antiferromagnetic correlations and the Mott gap in the half-filled, two dimensional, repulsive Hubbard model. We employ Hartree-Fock (HF) and Quantum Monte Carlo (QMC) techniques in our study of the bond and site disordered models. Results from mean field (HF) calculations are used to develop a qualitative picture of the physics and to guide our choice for input to the QMC methods. The basic properties of two QMC methods for correlated fermions are discussed, and the results from these different approaches are presented.

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We study the effects of disorder on long range antiferromagnetic correlations and the Mott gap in the half-filled, two dimensional, repulsive Hubbard model. We employ Hartree-Fock (HF) and Quantum Monte Carlo (QMC) techniques in our study of the bond and site disordered models. Results from mean field (HF) calculations are used to develop a qualitative picture of the physics and to guide our choice for input to the QMC methods. The basic properties of two QMC methods for correlated fermions are discussed, and the results from these different approaches are presented.
We study the effects of disorder on long-range antiferromagnetic correlations in the half-filled, two-dimensional, repulsive Hubbard model at T=0.T=0.T=0. A mean field approach is first employed to gain a qualitative picture of the physics and to guide our choice for a trial wave function in a constrained path quantum Monte Carlo (CPQMC) method that allows for a more accurate treatment of correlations. Within the mean field calculation, we observe both Anderson and Mott insulating antiferromagnetic phases. There are transitions to a paramagnet only for relatively weak coupling, U<2tU<2tU<2t in the case of bond disorder, and U<4tU<4tU<4t in the case of on-site disorder. Using ground-state CPQMC we demonstrate that this mean field approach significantly overestimates magnetic order. For U=4t,U=4t,U=4t, we find a critical bond disorder of ${V}_{c}\ensuremath{\approx}(1.6\ifmmode\pm\else\textpm\fi{}0.4)t$ even though within mean field theory no paramagnetic phase is found for this value of the interaction. In the site disordered case, we find a critical disorder of ${V}_{c}\ensuremath{\approx}(5.0\ifmmode\pm\else\textpm\fi{}0.5)t$ at U=4t.U=4t.U=4t.
The Hubbard model is studied in which disorder is introduced by putting the on-site interaction to zero on a fraction f of (impurity) sites of a square lattice. Using Quantum Monte Carlo methods and Dynamical Mean–Field Theory we find that antiferromagnetic long–range order is initially enhanced at half–filling and stabilized off half-filling by the disorder. The Mott-Hubbard charge gap of the pure system is broken up in two pieces by the disorder: one incompressible state remains at average density n = 1 and another can be seen slightly below n = 1 + f. Qualitative explanations are provided.
The two-dimensional Hubbard model in the presence of diagonal and off-diagonal disorder is studied at half-filling with a finite-temperature quantum Monte Carlo method. Magnetic correlations as well as the electronic compressibility are calculated to determine the behavior of local magnetic moments, the stability of antiferromagnetic long-range order (AFLRO), and properties of the disordered phase. The existence of random potentials (diagonal or ``site'' disorder) leads to a suppression of local magnetic moments which eventually destroys AFLRO. Randomness in the hopping elements (off-diagonal disorder), on the other hand, does not significantly reduce the density of local magnetic moments. For this type of disorder, at half-filling, there is no ``sign problem'' in the simulations as long as the hopping is restricted between neighbor sites on a bipartite lattice. This allows the study of sufficiently large lattices and low temperatures to perform a finite-size scaling analysis. For off-diagonal disorder, AFLRO is eventually destroyed when the fluctuations of antiferromagnetic exchange couplings exceed a critical value. The disordered phase close to the transition appears to be incompressible, and shows an increase of the uniform susceptibility at low temperatures.
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We study the ground state of the two-dimensional (2D) disordered Hubbard model by means of the projector quantum Monte Carlo (PQMC) method. This approach allows us to investigate the ground state properties of this model for lattice sizes up to 10×1010 \times 1010×10, at quarter filling, for a broad range of interaction and disorder strengths. Our results show that the ground state of this system of spin-1/2 fermions remains localised in the presence of the short-ranged Hubbard interaction.