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Physica C Superconductivity

Correlation functions for the one-dimensional Hubbard model: Variational approach for small U

J. M. P. Carmelo, D. Baeriswyl

Published Jun 1, 1988• 4 citations
Publisher
DOI
10.1016/0921-4534(88)90281-x

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We show that a particular class of variational wave functions reproduces the low-energy properties of the Hubbard model in one dimension. Our approach generalizes to finite on-site Coulomb repulsion the fully projected wave function proposed by Hellberg and Mele [Phys. Rev. Lett. 67, 2080 (1991)] for describing the Luttinger-liquid behavior of the doped $t\ensuremath{-}J$ model. Within our approach, the long-range Jastrow factor emerges from a careful minimization of the energy, without assuming any parametric form for the long-distance tail. Specifically, in the conducting phase of the Hubbard model at finite hole doping, we obtain the correct power-law behavior of the correlations, with the exponents predicted by the Tomonaga-Luttinger theory. By decreasing the doping, the insulating phase is reached with a continuous change of the small-qqq part of the Jastrow factor.
The Gutzwiller wave function for a strongly correlated model can, if supplemented with a long-range Jastrow factor, provide a proper variational description of Mott insulators, so far unavailable. We demonstrate this concept in the prototypical one-dimensional t-t(') Hubbard model, where at half-filling we reproduce all known phases, namely, the ordinary Mott undimerized insulator with power-law spin correlations at small t(')/t, the spin-gapped metal above a critical t(')/t and small U, and the dimerized Mott insulator at large repulsion.
We revisit the accuracy of the variational Monte Carlo (VMC) method by taking an example of ground state properties for the one-dimensional Hubbard model. We start from the variational wave functions with the Gutzwiller and long-range Jastrow factor introduced by Capello et al. [Phys. Rev. B 72 , 085121 (2005)] and further improve it by considering several quantum-number projections and a generalized one-body wave function. We find that the quantum spin projection and total momentum projection greatly improve the accuracy of the ground state energy within 0.5% error, for both small and large systems at half filling. Besides, the momentum distribution function n ( k ) at quarter filling calculated up to 196 sites allows us direct estimate of the critical exponents of the charge correlations from the power-law behavior of n ( k ) near the Fermi wave vector. Estimated critical exponents well reproduce those predicted by the Tomonaga-Luttinger theory.