1,690 research outputs found

    A Model Study of the Low-Energy Charge Dynamics of NaV_2O_5

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    An exact-diagonalization technique on small clusters is used to calculate the dynamical density correlation functions of the dimerized t-J chain and coupled anisotropic t-J ladders (trellis lattice) at quarter filling, i.e., the systems regarded as a network of pairs (dimers or rungs) of sites coupled weakly via the hopping and exchange interactions. We thereby demonstrate that the intersite Coulomb repulsions between the pairs induce a low-energy collective mode in the charge excitations of the systems where the internal charge degrees of freedom of the pairs play an essential role. Implications to the electronic states of NaV_2O_5, i.e., fluctuations of the valence state of V ions and phase transition as a charge ordering, are discussed.Comment: 4 pages, 4 gif figures. Hardcopies of figures (or the entire manuscript) can be obtained by e-mail request to [email protected]

    Single-Particle Dynamics in the Vicinity of the Mott-Hubbard Metal-to-Insulator Transition

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    The single-particle dynamics close to a metal-to-insulator transition induced by strong repulsive interaction between the electrons is investigated. The system is described by a half-filled Hubbard model which is treated by dynamic mean-field theory evaluated by high-resolution dynamic density-matrix renormalization. We provide theoretical spectra with momentum resolution which facilitate the comparison to photoelectron spectroscopy.Comment: 22 pages, 24 figures, comprehensive high-resolution study of single electron dynamics around a Mott metal-insulator transition, with momentum resolved spectral densities; slight changes due to referees' suggestion

    Coexistence of distinct charge fluctuations in θ\theta-(BEDT-TTF)2_2X

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    Using the Lanczos exact-diagonalization and density-matrix renormalization group methods, we study the extended Hubbard model at quarter filling defined on the anisotropic triangular lattice. We focus on charge ordering (CO) phenomena induced by onsite and intersite Coulomb interactions. We determine the ground-state phase diagram including three CO phases, i.e., diagonal, vertical, and three-fold CO phases, based on the calculated results of the hole density and double occupancy. We also calculate the dynamical density-density correlation functions and find possible coexistence of the diagonal and three-fold charge fluctuations in a certain parameter region where the onsite and intersite interactions compete. Furthermore, the characteristic features of the optical conductivity for each CO phase are discussed.Comment: 9 pages, 7 figure

    Charge Ordering in the One-Dimensional Extended Hubbard Model: Implication to the TMTTF Family of Organic Conductors

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    We study the charge ordering (CO) in the one-dimensional (1D) extended Hubbard model at quarter filling where the nearest-neighbor Coulomb repulsion and dimerization in the hopping parameters are included. Using the cluster mean-field approximation to take into account the effect of quantum fluctuations, we determine the CO phase boundary of the model in the parameter space at T=0 K. We thus find that the dimerization suppresses the stability of the CO phase strongly, and in consequence, the realistic parameter values for quasi-1D organic materials such as (TMTTF)2_2PF6_6 are outside the region of CO. We suggest that the long-range Coulomb interaction between the chains should persist to stabilize the CO phase.Comment: 5 pages, 4 eps figures, to appear in 15 Nov. 2001 issue of PR

    Brueckner-Goldstone perturbation theory for the half-filled Hubbard model in infinite dimensions

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    We use Brueckner-Goldstone perturbation theory to calculate the ground-state energy of the half-filled Hubbard model in infinite dimensions up to fourth order in the Hubbard interaction. We obtain the momentum distribution as a functional derivative of the ground-state energy with respect to the bare dispersion relation. The resulting expressions agree with those from Rayleigh-Schroedinger perturbation theory. Our results for the momentum distribution and the quasi-particle weight agree very well with those obtained earlier from Feynman-Dyson perturbation theory for the single-particle self-energy. We give the correct fourth-order coefficient in the ground-state energy which was not calculated accurately enough from Feynman-Dyson theory due to the insufficient accuracy of the data for the self-energy, and find a good agreement with recent estimates from Quantum Monte-Carlo calculations.Comment: 15 pages, 8 fugures, submitted to JSTA

    Metal-insulator transition in the Edwards model

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    To understand how charge transport is affected by a background medium and vice versa we study a two-channel transport model which captures this interplay via a novel, effective fermion-boson coupling. By means of (dynamical) DMRG we prove that this model exhibits a metal-insulator transition at half-filling, where the metal typifies a repulsive Luttinger liquid and the insulator constitutes a charge density wave. The quantum phase transition point is determined consistently from the calculated photoemission spectra, the scaling of the Luttinger liquid exponent, the charge excitation gap, and the entanglement entropy.Comment: 4 pages, 3 figures, contributions to SCES 201

    Anomalous behaviors of the charge and spin degrees of freedom in the CuO double chains of PrBa2_2Cu4_4O8_8

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    The density-matrix renormalization-group method is used to study the electronic states of a two-chain Hubbard model for CuO double chains of PrBa2_2Cu4_4O8_8. We show that the model at quarter filling has the charge ordered phases with stripe-type and in-line--type patterns in the parameter space, and in-between, there appears a wide region of vanishing charge gap; the latter phase is characteristic of either Tomonaga-Luttinger liquid or a metallic state with a spin gap. We argue that the low-energy electronic state of the CuO double chains of PrBa2_2Cu4_4O8_8 should be in the metallic state with a possibly small spin gap.Comment: REVTEX 4, 10 pages, 9 figures; submitted to PR
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