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arXiv:1203.1727 · Physical Review B

Diffusive high-temperature transport in the one-dimensional Hubbard model

Tomaž Prosen, Marko Žnidarič

Published Sep 14, 2012• 71 citations
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Abstract

We consider charge and spin transport in the one-dimensional Hubbard model at infinite temperature, half-filling, and zero magnetization. Implementing matrix-product-operator simulations of the nonequilibrium steady states of boundary-driven open Hubbard chains for up to 100 sites we find clear numerical evidence of diffusive transport for weak driving and any (nonzero and finite) value of the interaction $U$. In addition, nonequilibrium steady states are characterized by nonzero spin-up spin-down density-density correlations. For maximal driving, on the other hand, we find an insulating behavior and cosine-shaped density profiles.

DOI
10.1103/physrevb.86.125118

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We consider charge and spin transport in the one-dimensional Hubbard model at infinite temperature, half-filling, and zero magnetization. Implementing matrix-product-operator simulations of the nonequilibrium steady states of boundary-driven open Hubbard chains for up to 100 sites we find clear numerical evidence of diffusive transport for weak driving and any (nonzero and finite) value of the interaction UUU. In addition, nonequilibrium steady states are characterized by nonzero spin-up spin-down density-density correlations. For maximal driving, on the other hand, we find an insulating behavior and cosine-shaped density profiles.
We study the real-time and real-space dynamics of charge in the one-dimensional Hubbard model in the limit of high temperatures. To this end, we prepare pure initial states with sharply peaked density profiles and calculate the time evolution of these nonequilibrium states, by using numerical forward-propagation approaches to chains as long as 20 sites. For a class of typical states, we find excellent agreement with linear-response theory and unveil the existence of remarkably clean charge diffusion in the regime of strong particle-particle interactions. We additionally demonstrate that, in the half-filling sector, this diffusive behavior does not depend on certain details of our initial conditions, i.e., it occurs for five different realizations with random and nonrandom internal degrees of freedom, single and double occupation of the central site, and displacement of spin-up and spin-down particles.
Finite-temperature T > 0 transport properties of integrable and nonintegrable one-dimensional (1D) many-particle quantum systems are rather different, showing ballistic and diffusive behavior, respectively. The repulsive 1D Hubbard model is a prominent example of an integrable correlated system. For electronic densities n ≠ 1 (and spin densities m ≠ 0) it is an ideal charge (and spin) conductor, with ballistic charge (and spin) transport for T ⩾ 0. In spite of the fact that it is solvable by the Bethe ansatz, at n = 1 (and m = 0) its T > 0 charge (and spin) transport properties are an issue that remains poorly understood. Here we combine this solution with symmetry and the explicit calculation of current-operator matrix elements between energy eigenstates to show that for on-site repulsion U > 0 and at n = 1 the charge stiffness D η ( T ) vanishes for T > 0 in the thermodynamic limit. A similar behavior is found by such methods for the spin stiffness D s ( T ) for U > 0 and T > 0, which vanishes at m = 0. This absence of finite temperature n = 1 ballistic charge transport and m = 0 ballistic spin transport are exact results that clarify long-standing open problems.
We study finite-temperature transport properties of the one-dimensional Hubbard model using the density matrix renormalization group. Our aim is twofold: First, we compute both the charge- and the spin-current correlation function of the integrable model at half filling. The former decays rapidly, implying that the corresponding Drude weight is either zero or very small. Second, we calculate the optical charge conductivity ${\ensuremath{\sigma}}_{r}eg(\ensuremath{\omega})$ in the presence of small integrability-breaking next-nearest-neighbor interactions (the extended Hubbard model). The dc conductivity is finite and diverges as the temperature is decreased below the gap. Our results thus suggest that the half-filled, gapped Hubbard model is a normal charge conductor at finite temperatures. As a test bed for our numerics, we compute ${\ensuremath{\sigma}}_{r}eg(\ensuremath{\omega})$ for the integrable XXZ spin chain in its gapped phase.
One of the most straightforward ways to study thermal properties beyond linear response is to monitor the relaxation of an arbitrarily large left-right temperature gradient ${T}_{L}\ensuremath{-}{T}_{R}$. In one-dimensional systems which support ballistic thermal transport, the local energy currents $\ensuremath{\langle}j(t)\ensuremath{\rangle}$ acquire a nonzero value at long times, and it was recently investigated whether or not this steady state fulfills a simple additive relation $\ensuremath{\langle}j(t\ensuremath{\rightarrow}\ensuremath{\infty})\ensuremath{\rangle}=f({T}_{L})\ensuremath{-}f({T}_{R})$ in integrable models. In this paper, we probe the nonequilibrium dynamics of the Hubbard chain using density matrix renormalization group (DMRG) numerics. We show that the above form provides an effective description of thermal transport in this model; violations are below the finite-time accuracy of the DMRG. As a second setup, we study how an initially equilibrated system radiates into different nonthermal states (such as the vacuum).
Nonlinear transport in the one dimensional Hubbard model at half-filling under a finite bias voltage is investigated by the adaptive time-dependent density matrix renormalization group method. For repulsive on-site interaction, dielectric breakdown of the Mott insulating ground state to a current-carrying nonequilibrium steady state is clearly observed when the voltage exceeds the charge gap. It is found that by increasing the voltage further the current-voltage characteristics are scaled only by the charge gap and the scaling curve exhibits almost linear dependence on the voltage whose slope is suppressed by the electron correlation. In the case of attractive interaction the linear conductance is the perfect one 2e2/h2e^2/h2e2/h which agrees with the prediction by the Luttinger liquid theory.
Correlation-driven metal-insulator transitions and temperature-driven quantum-coherent-to-incoherent crossovers in correlated electron systems underpin the doping, temperature and frequency-resolved evolution of physical responses. Motivated by recent experimental studies that investigate the evolution of dynamical spin and charge responses, we analyze the spin and charge diffusion spectra in both half-filled and doped one-band Hubbard model using Dynamical Mean Field Theory (DMFT) combined with the Numerical Renormalization Group (NRG). We compare the relative strengths and limitations of Density Matrix NRG (DMNRG) and Full Density Matrix NRG (FDM-NRG) in capturing low-frequency spectral features and their evolution with temperature, interaction strength and band-filling. Key measures, including characteristic frequency scales, Kullback-Leibler divergence, diffusion constants, and kurtosis provide complementary but internally consistent picture for the evolution of spin and charge excitations across bandwidth as well as the band-filling driven Mott transitions and the coherent-incoherent crossover. We find that spin and charge fluctuations cross over from quantum-coherent-to-quantum-incoherent at distinct temperatures, providing a microscopic insight into the complex, two-stage, Fermi-to-non-Fermi liquid-to-bad metal crossovers seen in transport data, in particular in the dcdcdc resistivity.