2011Physical Review BOpen access

Strong-coupling approach to the Mott-Hubbard insulator on a Bethe lattice in dynamical mean-field theory

Steffen Rühl, Florian Gebhard

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Abstract

We calculate the Hubbard bands for the half-filled Hubbard model on a Bethe lattice with an infinite coordination number up to and including third order in the inverse Hubbard interaction. We employ the Kato-Takahashi perturbation theory to solve the self-consistency equation of the dynamical mean-field theory analytically for the single-impurity Anderson model in multichain geometry. The weight of the secondary Hubbard sub-bands is of fourth order so that the two-chain geometry is sufficient for our study. Our results for the Mott-Hubbard gap and the density of states of the lower Hubbard band agree very well with those from numerical dynamical density-matrix renormalization group calculations, apart from a resonance contribution at the upper band edge, which cannot be reproduced in low-order perturbation theory.

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We calculate the Hubbard bands for the half-filled Hubbard model on a Bethe lattice with an infinite coordination number up to and including third order in the inverse Hubbard interaction. We employ the Kato-Takahashi perturbation theory to solve the self-consistency equation of the dynamical mean-field theory analytically for the single-impurity Anderson model in multichain geometry. The weight of the secondary Hubbard sub-bands is of fourth order so that the two-chain geometry is sufficient for our study. Our results for the Mott-Hubbard gap and the density of states of the lower Hubbard band agree very well with those from numerical dynamical density-matrix renormalization group calculations, apart from a resonance contribution at the upper band edge, which cannot be reproduced in low-order perturbation theory.

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Available abstract

We calculate the Hubbard bands for the half-filled Hubbard model on a Bethe lattice with an infinite coordination number up to and including third order in the inverse Hubbard interaction. We employ the Kato-Takahashi perturbation theory to solve the self-consistency equation of the dynamical mean-field theory analytically for the single-impurity Anderson model in multichain geometry. The weight of the secondary Hubbard sub-bands is of fourth order so that the two-chain geometry is sufficient for our study. Our results for the Mott-Hubbard gap and the density of states of the lower Hubbard band agree very well with those from numerical dynamical density-matrix renormalization group calculations, apart from a resonance contribution at the upper band edge, which cannot be reproduced in low-order perturbation theory.

Key concepts: Hubbard model, Bethe lattice, Dynamical mean field theory, Physics, Mott insulator, Perturbation theory (quantum mechanics), Renormalization group, Condensed matter physics

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