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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. Moreover, we demonstrate that 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., Comment: 5 pages, 4 figures (+ 3 pages, 5 figures)

The real-time broadening of density profiles starting from non-equilibrium states is at the center of transport in condensed-matter systems and dynamics in ultracold atomic gases. Initial profiles close to equilibrium are expected to evolve according to linear response, e.g., as given by the current correlator evaluated exactly at equilibrium. Significantly off equilibrium, linear response is expected to break down and even a description in terms of canonical ensembles is questionable. We unveil that single pure states with density profiles of maximum amplitude yield a broadening in perfect agreement with linear response, if the structure of these states involves randomness in terms of decoherent off-diagonal density-matrix elements. While these states allow for spin diffusion in the XXZ spin-1/2 chain at large exchange anisotropies, coherences yield entirely different behavior., Comment: 7 pages, 7 figures, accepted for publication in Phys. Rev. B

Since the first suggestion of the Jarzynski equality many derivations of this equality have been presented in both, the classical and the quantum context. While the approaches and settings greatly differ from one to another, they all appear to rely on the initial state being a thermal Gibbs state. Here, we present an investigation of work distributions in driven isolated quantum systems, starting off from pure states that are close to energy eigenstates of the initial Hamiltonian. We find that, for the nonintegrable system in quest, the Jarzynski equality is fulfilled to good accuracy., Comment: 9 pages, 7 figures

The interplay between the singlet ground state of the antiferromagnetic Heisenberg model and the experimentally measured N\'eel state of antiferromagnets is studied. To verify the hypothesis [M. I. Katsnelson et al., Phys. Rev. B 63, 212404 (2001)] that the latter can be considered to be a result of local measurements destroying the entanglement of the quantum ground state, we have performed systematic simulations of the effects of von Neumannmeasurements for the case of a one-dimensional antiferromagnetic spin-1/2 system for various types and degrees of magnetic anisotropies. It is found that in the ground state, a magnetization measurement can create decoherence waves [M. I. Katsnelson et al. Phys. Rev. A 62, 022118 (2000)] in the magnetic sublattices, and that a symmetry breaking anisotropy does not lead to alignment of the spins in a particular direction. However, for an easy-axis anisotropy of the same order magnitude as the exchange constant, a measurement on the singlet ground state can create N\'eel-ordering in finite systems of experimentally accessible size.

We study measures of decoherence and thermalization of a quantum system $S$ in the presence of a quantum environment (bath) $E$. The entirety $S$$+$$E$ is prepared in a canonical thermal state at a finite temperature, that is the entirety is in a steady state. Both our numerical results and theoretical predictions show that measures of the decoherence and the thermalization of $S$ are generally finite, even in the thermodynamic limit, when the entirety $S$$+$$E$ is at finite temperature. Notably, applying perturbation theory with respect to the system-environment coupling strength, we find that under common Hamiltonian symmetries, up to first order in the coupling strength it is sufficient to consider $S$ uncoupled from $E$, but entangled with $E$, to predict decoherence and thermalization measures of $S$. This decoupling allows closed form expressions for perturbative expansions for the measures of decoherence and thermalization in terms of the free energies of $S$ and of $E$. Large-scale numerical results for both coupled and uncoupled entireties with up to 40 quantum spins support these findings., Comment: 46 pages, 21 figures, long appendix includes the perturbation theory calculation details

We study the charge conductivity of the one-dimensional repulsive Hubbard model at finite temperature using the method of dynamical quantum typicality, focusing at half filling. This numerical approach allows us to obtain current autocorrelation functions from systems with as many as 18 sites, way beyond the range of standard exact diagonalization. Our data clearly suggest that the charge Drude weight vanishes with a power law as a function of system size. The low-frequency dependence of the conductivity is consistent with a finite dc value and thus with diffusion, despite large finite-size effects. Furthermore, we consider the mass-imbalanced Hubbard model for which the charge Drude weight decays exponentially with system size, as expected for a non-integrable model. We analyze the conductivity and diffusion constant as a function of the mass imbalance and we observe that the conductivity of the lighter component decreases exponentially fast with the mass-imbalance ratio. While in the extreme limit of immobile heavy particles, the Falicov-Kimball model, there is an effective Anderson-localization mechanism leading to a vanishing conductivity of the lighter species, we resolve finite conductivities for an inverse mass ratio of $\eta \gtrsim 0.25$., Comment: 13 pages, 11 figures

We study the dynamics of spin currents in the XX spin-1/2 ladder at finite temperature. Within the framework of linear response theory, we numerically calculate autocorrelation functions for quantum systems larger than what is accessible with exact diagonalization using the concept of dynamical quantum typicality. We show that spin Drude weights vanish exponentially fast with increasing system size. As a main result, we unveil qualitatively different dependencies of the spin diffusion coefficient on the rung-interaction strength, resulting from a crossover from exponential to Gaussian dissipation as the rung coupling increases. This behavior is also derived analytically. We further discuss the relation of our results to experiments with cold atomic gases., Comment: 7 pages, 7 figures, accepted for publication in Phys. Rev. B

We determine the classical and quantum complexities of a specific ensemble of three-satisfiability problems with a unique satisfying assignment for up to N=100 and N=80 variables, respectively. In the classical limit we employ generalized ensemble techniques and measure the time that a Markovian Monte Carlo process spends in searching classical ground states. In the quantum limit we determine the maximum finite correlation length along a quantum adiabatic trajectory determined by the linear sweep of the adiabatic control parameter in the Hamiltonian composed of the problem Hamiltonian and the constant transverse field Hamiltonian. In the median of our ensemble both complexities diverge exponentially with the number of variables. Hence, standard, conventional adiabatic quantum computation fails to reduce the computational complexity to polynomial. Moreover, the growth-rate constant in the quantum limit is 3.8 times as large as the one in the classical limit, making classical fluctuations more beneficial than quantum fluctuations in ground-state searches.

Through numerical solution of the time-dependent Schrodinger equation, we demonstrate that magnetic chains with uniaxial anisotropy support stable structures, separating ferromagnetic domains of opposite magnetization. These structures, domain walls in a quantum system, are shown to remain stable if they interact with a spin wave. We find that a domain wall transmits the longitudinal component of the spin excitations only. Our results suggests that continuous, classical spin models described by LLG equation cannot be used to describe spin wave-domain wall interaction in microscopic magnetic systems.

The magnetic energy-level diagrams for models of the Mn12 and V15 molecule are calculated using the Lanczos method with full orthogonalization and a Chebyshev-polynomial-based projector method. The effect of the Dzyaloshinskii-Moriya interaction on the appearance of energy-level repulsions and its relevance to the observation of steps in the time-dependent magnetization data is studied. We assess the usefulness of simplified models for the description of the zero-temperature magnetization dynamics.

We discuss the effect of the thermal environment on the low-temperature response of the magnetization of uniaxial magnets to a time-dependent applied magnetic field. At sufficiently low temperatures the staircase magnetization curves observed in molecular magnets such as Mn_{12} and Fe_8 display little temperature dependence. However the changes of the magnetization at each step do not seem to be directly related to the probability for a quantum mechanical nonadiabatic transition. In order to explain this deceptive apparent nonadiabatic behavior, we study the quantum dynamics of the system in a thermal environment and propose a relation between the observed magnetization steps and the quantum mechanical transition probability due to the nonadiabatic transition., Comment: 4 pages, 7 eps figures