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arXiv:0809.1947 · Physical Review A

Finite-size effects for the gap in the excitation spectrum of the one-dimensional Hubbard model

Maria Colomé‐Tatché, Sergey I. Matveenko, Gora V. Shlyapnikov

Published Jan 19, 2010• 1 citation
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Abstract

We study finite-size effects for the gap of the quasiparticle excitation spectrum in the weakly interacting regime one-dimensional Hubbard model with on-site attraction. Two types of corrections to the result of the thermodynamic limit are obtained. Aside from a power law (conformal) correction due to gapless excitations which behaves as $1/{N}_{a}$, where ${N}_{a}$ is the number of lattice sites, we obtain corrections related to the existence of gapped excitations. First of all, there is an exponential correction which in the weakly interacting regime ($|U|\ensuremath{\ll}t$) behaves as $~$$\mathrm{exp}(\ensuremath{-}{N}_{a}{\ensuremath{\Delta}}_{\ensuremath{\infty}}/4t)$ in the extreme limit of ${N}_{a}{\ensuremath{\Delta}}_{\ensuremath{\infty}}/t\ensuremath{\gg}1$, where $t$ is the hopping amplitude, $U$ is the on-site energy, and ${\ensuremath{\Delta}}_{\ensuremath{\infty}}$ is the gap in the thermodynamic limit. Second, in a finite-size system a spin-flip producing unpaired fermions leads to the appearance of solitons with nonzero momenta, which provides an extra (nonexponential) contribution $\ensuremath{\delta}$. For moderate but still large values of ${N}_{a}{\ensuremath{\Delta}}_{\ensuremath{\infty}}/t$, these corrections significantly increase and may become comparable with the $1/{N}_{a}$ conformal correction. Moreover, in the case of weak interactions where ${\ensuremath{\Delta}}_{\ensuremath{\infty}}\ensuremath{\ll}t$, the exponential correction exceeds higher-order power law corrections in a wide range of parameters, namely for ${N}_{a}\ensuremath{\lesssim}(8t/{\ensuremath{\Delta}}_{\ensuremath{\infty}})\mathrm{ln}(4t/|U|)$, and so does $\ensuremath{\delta}$ even in a wider range of ${N}_{a}$. For a sufficiently small number of particles, which can be of the order of thousands in the weakly interacting regime, the gap is fully dominated by finite-size effects.

DOI
10.1103/physreva.81.013611

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We study finite-size effects for the gap of the quasiparticle excitation spectrum in the weakly interacting regime one-dimensional Hubbard model with on-site attraction. Two types of corrections to the result of the thermodynamic limit are obtained. Aside from a power law (conformal) correction due to gapless excitations which behaves as 1/Na1/{N}_{a}1/Na​, where Na{N}_{a}Na​ is the number of lattice sites, we obtain corrections related to the existence of gapped excitations. First of all, there is an exponential correction which in the weakly interacting regime (∣U∣\ensuremath≪t|U|\ensuremath{\ll}t∣U∣\ensuremath≪t) behaves as ~$$\mathrm{exp}(\ensuremath{-}{N}_{a}{\ensuremath{\Delta}}_{\ensuremath{\infty}}/4t) in the extreme limit of Na\ensuremathΔ\ensuremath∞/t\ensuremath≫1{N}_{a}{\ensuremath{\Delta}}_{\ensuremath{\infty}}/t\ensuremath{\gg}1Na​\ensuremathΔ\ensuremath∞​/t\ensuremath≫1, where ttt is the hopping amplitude, UUU is the on-site energy, and \ensuremathΔ\ensuremath∞{\ensuremath{\Delta}}_{\ensuremath{\infty}}\ensuremathΔ\ensuremath∞​ is the gap in the thermodynamic limit. Second, in a finite-size system a spin-flip producing unpaired fermions leads to the appearance of solitons with nonzero momenta, which provides an extra (nonexponential) contribution \ensuremathδ\ensuremath{\delta}\ensuremathδ. For moderate but still large values of Na\ensuremathΔ\ensuremath∞/t{N}_{a}{\ensuremath{\Delta}}_{\ensuremath{\infty}}/tNa​\ensuremathΔ\ensuremath∞​/t, these corrections significantly increase and may become comparable with the 1/Na1/{N}_{a}1/Na​ conformal correction. Moreover, in the case of weak interactions where \ensuremathΔ\ensuremath∞\ensuremath≪t{\ensuremath{\Delta}}_{\ensuremath{\infty}}\ensuremath{\ll}t\ensuremathΔ\ensuremath∞​\ensuremath≪t, the exponential correction exceeds higher-order power law corrections in a wide range of parameters, namely for Na\ensuremath≲(8t/\ensuremathΔ\ensuremath∞)ln(4t/∣U∣){N}_{a}\ensuremath{\lesssim}(8t/{\ensuremath{\Delta}}_{\ensuremath{\infty}})\mathrm{ln}(4t/|U|)Na​\ensuremath≲(8t/\ensuremathΔ\ensuremath∞​)ln(4t/∣U∣), and so does \ensuremathδ\ensuremath{\delta}\ensuremathδ even in a wider range of Na{N}_{a}Na​. For a sufficiently small number of particles, which can be of the order of thousands in the weakly interacting regime, the gap is fully dominated by finite-size effects.
We analyse the thermodynamic Bethe Ansatz equations of the one-dimensional half-filled Hubbard model in the ‘spin-disordered regime’, which is characterized by the temperature being much larger than the magnetic energy scale, but small compared to the Mott–Hubbard gap. In this regime the thermodynamics of the Hubbard model can be thought of in terms of gapped charged excitations with an effective dispersion and spin degrees of freedom that only contribute entropically. In particular, the internal energy and the effective dispersion become essentially independent of temperature. An interpretation of this regime in terms of a putative interacting-electron system at zero temperature leads to a metal–insulator transition at a finite interaction strength above which the gap opens linearly. We relate these observations to studies of the Mott–Hubbard transition in the limit of infinite dimensions.
The two-dimensional Hubbard model is studied for small values of the interaction strength (UUU of the order of the hopping amplitude ttt), using a variational ansatz well suited for this regime. The wave function, a refined Gutzwiller ansatz, has a BCS mean-field state with ddd-wave symmetry as its reference state. Superconducting order is found for densities n<1n<1n<1 (but not for n=1n=1n=1). This resolves a discrepancy between results obtained with the functional renormalization group, which do predict superconducting order for small values of UUU, and numerical simulations, which did not find superconductivity for $U\ensuremath{\lesssim}4t$. Both the gap parameter and the order parameter have a domelike shape as a function of nnn with a maximum for $n\ensuremath{\approx}0.8$. Expectation values for the energy, the particle number, and the superconducting order parameter are calculated using a linked-cluster expansion up to second order in UUU. In this way large systems (millions of sites) can be readily treated and well converged results are obtained. A big size is indeed required to see that the gap becomes very small at half filling and probably tends to zero in the thermodynamic limit, whereas away from half filling a finite asymptotic limit is reached. For a lattice of a given size the order parameter becomes finite only above a minimal coupling strength Uc{U}_{c}Uc​. This threshold value decreases steadily with increasing system size, which indicates that superconductivity exists for arbitrarily small UUU for an infinite system. For moderately large systems the size dependence is quite irregular, due to variations in level spacings at the Fermi energy. The fluctuations die out if the gap parameter spans several level spacings.
We investigate the ground-state properties of trapped fermion systems described by the Hubbard model with an external confining potential. We discuss the universal behaviors of systems in different regimes: from few particles, i.e., in dilute regimes, to the trap thermodynamic limit. The asymptotic trap-size (TS) dependence in the dilute regime (increasing the trap size $\ensuremath{\ell}$ keeping the particle number NNN fixed) is described by a universal TS scaling controlled by the dilute fixed point associated with the metal-to-vacuum quantum transition. This scaling behavior is numerically checked by DMRG simulations of the one-dimensional (1D) Hubbard model. In particular, the particle density and its correlations show crossovers among different regimes: for strongly repulsive interactions they approach those of a spinless Fermi gas, for weak interactions those of a free Fermi gas, and for strongly attractive interactions they match those of a gas of hard-core bosonic molecules. The large-NNN limit keeping the ratio $N/\ensuremath{\ell}$ fixed corresponds to a 1D trap thermodynamic limit. We address issues related to the accuracy of the local density approximation (LDA). We show that the particle density approaches its LDA in the large-$\ensuremath{\ell}$ limit. When the trapped system is in the metallic phase, corrections at finite $\ensuremath{\ell}$ are $O({\ensuremath{\ell}}^{\ensuremath{-}1})$ and oscillating around the center of the trap. They become significantly larger at the boundary of the fermion cloud, where they get suppressed as $O({\ensuremath{\ell}}^{\ensuremath{-}1/3})$ only. This anomalous behavior arises from the nontrivial scaling at the metal-to-vacuum transition occurring at the boundaries of the fermion cloud.
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