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Transport and real-time dynamics in one-dimensional quantum magnets and ultra-cold atomic gases

Langer, Stephan Markus

Published Jan 1, 2012• 0 citations
Publisher

Abstract

The goal of this thesis is to study the transport properties and real-time dynamics of quantum magnets and ultra-cold atomic gases in one spatial dimension using numerical methods. The focus will be on the discussion of diffusive versus ballistic dynamics along with a detailed analysis of characteristic velocities in ballistic regimes. For the simulation of time-dependent density profiles we use the adaptive time-dependent density matrix renormalization group (DMRG). This numerical method allows for the simulation of time-dependent wave functions close to as well as far from equilibrium in a controlled manner. The studies of one-dimensional quantum magnets are partially motivated by the experimental evidence for a highly anisotropic and for insulators comparably high thermal conductivity of certain cuprates. We use linear response theory to study transport coefficients at arbitrary temperatures by diagonalizing small systems exactly and then calculating the current-current correlation functions. As first application we discuss the spin transport in the spin-$1/2$ Heisenberg chain with anisotropic exchange interactions (XXZ-chain). The second application of exact diagonalization, here in combination with time-dependent DMRG, is a discussion of the transverse components of the current-current correlation function. While usually only a Zeeman field is considered in the theory of transport coefficients, we here investigate the dynamic induced by an additional transverse magnetic field. We find that in this scenario the current-current correlation function exhibits coherent oscillations. In addition a second non-trivial frequency, different from the one expected from the usual Larmor precession, emerges and is studied varying temperature and field. Finally we calculate the frequency-dependent spin and heat conductivity of dimerized spin chains in a magnetic field. Motivated by the recent experimental studies of the phase diagram of C$_5$H$_{12}$N$_2$CuBr$_4$ we take the dimerized chain as a minimal model that exhibits features of the low-temperature region of the observed phase diagram. As a main result, the spin and heat conductivity obtained from linear response theory are enhanced in the field-induced gapless phase. The last application in the field of one-dimensional quantum magnets is the simulation of time-dependent energy-density wave-packets close to as well as far from equilibrium using the time-dependent density renormalization group. The main results are ballistic energy dynamics independently of how far out-of-equilibrium the initial state is and a detailed understanding of the average expansion velocity. The applications in the field of ultra-cold atomic gases focus on the sudden expansion of an initially trapped gas into an empty optical lattice. This setup was recently realized in an experiment performed by U. Schneider {\it et al.} and discussed in the context of electronic transport in the two-dimensional and the three-dimensional Fermi-Hubbard model. Here we investigate the sudden expansion of three different setups: For the expansion of a spin-balanced cloud of fermions, we identify the ballistic regime, and therein investigate the average expansion velocity of the cloud. As a main result the expansion velocity is determined by a small subset of the initial condition over a wide range of parameters. For instance, the Mott-insulating phase of the Hubbard model is characterized by a constant expansion velocity independently of the strength of the interaction. In the case of spinless bosons, we study the expansion from initial states that have a fixed particle number per lattice site and a certain concentration of defects. We study the expansion velocity as a function of interaction strength and investigate whether the time-dependent momentum distribution functions indicate a dynamical quasi-condensation. The last example is the sudden expansion of a spin-polarized gas of fermions in the presence of attractive interactions. This study is motivated by current effort to experimentally detect the Fulde-Ferrell-Larkin-Ovchinnikov state. Our results for the time-dependent momentum distribution functions and the wave-function of the pair condensate suggest that the signatures of the FFLO state vanish quickly, yet a stationary form of the momentum distribution also emerges fast. The latter is shown to be determined by the initial conditions, which might eventually allow for an indirect detection of the FFLO phase.

DOI
10.5282/edoc.14721

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The goal of this thesis is to study the transport properties and real-time dynamics of quantum magnets and ultra-cold atomic gases in one spatial dimension using numerical methods. The focus will be on the discussion of diffusive versus ballistic dynamics along with a detailed analysis of characteristic velocities in ballistic regimes. For the simulation of time-dependent density profiles we use the adaptive time-dependent density matrix renormalization group (DMRG). This numerical method allows for the simulation of time-dependent wave functions close to as well as far from equilibrium in a controlled manner. The studies of one-dimensional quantum magnets are partially motivated by the experimental evidence for a highly anisotropic and for insulators comparably high thermal conductivity of certain cuprates. We use linear response theory to study transport coefficients at arbitrary temperatures by diagonalizing small systems exactly and then calculating the current-current correlation functions. As first application we discuss the spin transport in the spin-1/21/21/2 Heisenberg chain with anisotropic exchange interactions (XXZ-chain). The second application of exact diagonalization, here in combination with time-dependent DMRG, is a discussion of the transverse components of the current-current correlation function. While usually only a Zeeman field is considered in the theory of transport coefficients, we here investigate the dynamic induced by an additional transverse magnetic field. We find that in this scenario the current-current correlation function exhibits coherent oscillations. In addition a second non-trivial frequency, different from the one expected from the usual Larmor precession, emerges and is studied varying temperature and field. Finally we calculate the frequency-dependent spin and heat conductivity of dimerized spin chains in a magnetic field. Motivated by the recent experimental studies of the phase diagram of C5_55​H12_{12}12​N2_22​CuBr4_44​ we take the dimerized chain as a minimal model that exhibits features of the low-temperature region of the observed phase diagram. As a main result, the spin and heat conductivity obtained from linear response theory are enhanced in the field-induced gapless phase. The last application in the field of one-dimensional quantum magnets is the simulation of time-dependent energy-density wave-packets close to as well as far from equilibrium using the time-dependent density renormalization group. The main results are ballistic energy dynamics independently of how far out-of-equilibrium the initial state is and a detailed understanding of the average expansion velocity. The applications in the field of ultra-cold atomic gases focus on the sudden expansion of an initially trapped gas into an empty optical lattice. This setup was recently realized in an experiment performed by U. Schneider {\it et al.} and discussed in the context of electronic transport in the two-dimensional and the three-dimensional Fermi-Hubbard model. Here we investigate the sudden expansion of three different setups: For the expansion of a spin-balanced cloud of fermions, we identify the ballistic regime, and therein investigate the average expansion velocity of the cloud. As a main result the expansion velocity is determined by a small subset of the initial condition over a wide range of parameters. For instance, the Mott-insulating phase of the Hubbard model is characterized by a constant expansion velocity independently of the strength of the interaction. In the case of spinless bosons, we study the expansion from initial states that have a fixed particle number per lattice site and a certain concentration of defects. We study the expansion velocity as a function of interaction strength and investigate whether the time-dependent momentum distribution functions indicate a dynamical quasi-condensation. The last example is the sudden expansion of a spin-polarized gas of fermions in the presence of attractive interactions. This study is motivated by current effort to experimentally detect the Fulde-Ferrell-Larkin-Ovchinnikov state. Our results for the time-dependent momentum distribution functions and the wave-function of the pair condensate suggest that the signatures of the FFLO state vanish quickly, yet a stationary form of the momentum distribution also emerges fast. The latter is shown to be determined by the initial conditions, which might eventually allow for an indirect detection of the FFLO phase.
Using the adaptive time-dependent density matrix renormalization group method, we numerically study the spin dynamics and transport in one-dimensional spin-1/2 systems at zero temperature. Instead of computing transport coefficients from linear-response theory, we study the real-time evolution of the magnetization starting from spatially inhomogeneous initial states. In particular, we are able to analyze systems far away from equilibrium with this setup. By computing the time dependence of the variance of the magnetization, we can distinguish diffusive from ballistic regimes, depending on model parameters. For the example of the anisotropic spin-1/2 chain and at half filling, we find the expected ballistic behavior in the easy-plane phase, while in the massive regime the dynamics of the magnetization is diffusive. Our approach allows us to tune the deviation of the initial state from the ground state and the qualitative behavior of the dynamics turns out to be valid even for highly perturbed initial states in the case of easy-plane exchange anisotropies. We further cover two examples of nonintegrable models, the frustrated chain and the two-leg spin ladder, and we encounter diffusive transport in all massive phases. In the former system, our results indicate ballistic behavior in the critical phase. We propose that the study of the time dependence of the spatial variance of particle densities could be instrumental in the characterization of the expansion of ultracold atoms in optical lattices as well.
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We study the spin and energy dynamics in one-dimensional spin-12\frac{1}{2}21​ systems induced by local quantum quenches at finite temperatures using a time-dependent density matrix renormalization group method. System sizes are chosen large enough to ensure that the time-dependent data for the accessible time scales represent the behavior in the thermodynamic limit. As a main result, we observe a ballistic spreading of perturbations of the energy density in the integrable spin-12\frac{1}{2}21​ XXZ chain for all temperatures and exchange anisotropies, related to the divergent thermal conductivity in this model and the exact conservation of the energy current. In contrast, the spin dynamics is ballistic in the massless phase, but shows a diffusive behavior at high temperatures in the easy-axis phase in the case of a vanishing background spin density. We extract a quantitative estimate for the spin-diffusion constant from the time dependence of the spatial variance of the spin density, which agrees well with values obtained from current-current correlation functions using an Einstein relation. Interestingly, the diffusion constant approaches a constant value deep in the easy-axis regime. As an example for nonintegrable models, we consider two-leg ladders, for which we observe indications of diffusive energy and spin dynamics. The relevance of our results for recent experiments with quantum magnets and bosons in optical lattices is discussed.
The impact of lattice vibrations on the electric conductivity has been considered a settled issue since the proof of the Migdal theorem. The precondition for its validity is a higher velocity of electronic than phononic excitation modes. In some new materials, e. g. weakly coupled spin chains and heavy fermion systems, this precondition is not fulfilled. The heat conductivity of such systems is calculated by means of perturbation theory in this work. Another subject is the interplay of Umklapp scattering and weak disorder in spin chains and one-dimensional correlated metals. Hidden conservation laws lead to a strong coupling between heat current and charge or spin current, respectively. The transport properties are calculated perturbatively within the hydrodynamic memory matrix formalism, which gives a lower bound to the conductivies. To calculate the Lorenz number of one-dimensional metals, we model within this formalism also the influence of phonons, which in physical systems contribute substantially to the heat current. The introduction of ultracold quantum gases in optical lattices in the recent years provides a powerful tool for the modeling of many systems to solid state physics, in particular systems out of equilibrium. The relatively slow dynamics of the cold atoms allows for time resolved imaging of the atoms and thus opens up new perspectives. In the last part of this thesis, a recent experiment, which measures the expansion of a correlated atom cloud in an optical lattice, is compared to a lattice Boltzmann simulation. Depending on the local density, the problem is shown to be described by the crossover from diffusive to ballistic transport.
This thesis studies transport properties of low-dimensional quantum spin systems with a particular focus on the transport of heat and spin. While the integrable anisotropic spin-1/2 chain exhibits ballistic transport (finite Drude weights), the numerical results of this work show that heat and spin transport of non-integrable models (spin ladder, frustrated and dimerized chain) is not ballistic, characterized by vanishing Drude weights in the thermodynamic limit. The results for the thermal conductivity of spin ladders are compared to experimental data. For the case of the spin-1/2 Heisenberg chain, this work contains detailed results for the temperature and magnetic field dependence of the Drude weights. Finally, bond-disordered spin systems are considered, namely the spin-1/2 chain and the spin ladder. In the first case, the transport coefficients are computed by means of exact diagonalization and discussed as a function of frequency, temperature, and magnetic field. In the second case, spectral properties of the elementary excitation of disordered spin ladders are analyzed using diagrammatic perturbation theory and numerical techniques.
In the study of quantum transport, much has been known about dynamics near thermal equilibrium. However, quantum transport far away from equilibrium is much less well understood---the linear response approximation does not hold for physics far out of equilibrium in general. In this work, motivated by recent cold atom experiments on probing quantum many-body dynamics of a one-dimensional XXZ spin chain, where a transition from ballistic to diffusive dynamics has been established by increasing the interaction strengths, we study the strong interaction limit of the one-dimensional spinless fermion model, which is dual to the XXZ spin chain. We develop a highly efficient computation algorithm for simulating the nonequilibrium dynamics of this system exactly, and examine the nonequilibrium dynamics starting from a density modulation quantum state. We find ballistic transport in this strongly correlated setting and show that a plane-wave description emerges at long-time evolution. We also observe a sharp distinction between transport velocities in short and long times as induced by interaction effects and provide a quantitative interpretation for the long-time transport velocity. We expect our results to shed light on the understanding of the dynamics of the XXZ spin chain in the strong interaction regime.