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arXiv2012

Kubo formulas for viscosity: Hall viscosity, Ward identities, and the relation with conductivity

We derive from first principles the Kubo formulas for the stress-stress response function at zero wavevector that can be used to define the full complex frequency-dependent viscosity tensor, both with and without a uniform magnetic field. The formulas in the existing literature are frequently incomplete, incorrect, or lack a derivation; in particular, Hall viscosity is overlooked. Our approach begins from the response to a uniform external strain field, which is an active time-dependent coordinate transformation in d space dimensions. These transformations form the group GL(d,R) of invertible matrices, and the infinitesimal generators are called strain generators. These enable us to express the Kubo formula in different ways, related by Ward identities; some of these make contact with the adiabatic transport approach. For Galilean-invariant systems, we derive a relation between the stress response tensor and the conductivity tensor that is valid at all frequencies and in both the presence and absence of a magnetic field. In the presence of a magnetic field and at low frequency, this yields a relation between the Hall viscosity, the q^2 part of the Hall conductivity, the inverse compressibility (suitably defined), and the diverging part of the shear viscosity (if any); this relation generalizes a result found recently. We show that the correct value of the Hall viscosity at zero frequency can be obtained (at least in the absence of low-frequency bulk and shear viscosity) by assuming that there is an orbital spin per particle that couples to a perturbing electromagnetic field as a magnetization per particle. We study several examples as checks on our formulation.

cond-mat.stat-mech↗

arXiv2013

Critical parameters from trap-size scaling in trapped particle systems

We investigate the critical behavior of trapped particle systems at the low-temperature superfluid transition. In particular, we consider the three-dimensional Bose-Hubbard model in the presence of a trapping harmonic potential coupled with the particle density, which is a realistic model of cold bosonic atoms in optical lattices. We present a numerical study based on quantum Monte Carlo simulations, analyzed in the framework of the trap-size scaling (TSS). We show how the critical parameters can be derived from the trap-size dependences of appropriate observables, matching them with TSS. This provides a systematic scheme which is supposed to exactly converge to the critical parameters of the transition in the large trap-size limit. Our numerical analysis may provide a guide for experimental investigations of trapped systems at finite-temperature and quantum transitions, showing how critical parameters may be determined by looking at the scaling of the critical modes with respect to the trap size, i.e. by matching the trap-size dependence of the experimental data with the expected TSS Ansatz.

cond-mat.stat-mech↗

arXiv2013

Holographic Symmetries and Generalized Order Parameters for Topological Matter

We introduce a universally applicable method, based on the bond-algebraic theory of dualities, to search for generalized order parameters in disparate systems including non-Landau systems with topological order. A key notion that we advance is that of {\em holographic symmetry}. It reflects situations wherein global symmetries become, under a duality mapping, symmetries that act solely on the system's boundary. Holographic symmetries are naturally related to edge modes and localization. The utility of our approach is illustrated by systematically deriving generalized order parameters for pure and matter-coupled Abelian gauge theories, and for some models of topological matter.

cond-mat.stat-mech↗

arXiv2013

Temperature dependent effective potential method for accurate free energy calculations of solids

We have developed a thorough and accurate method of determining anharmonic free energies, the temperature dependent effective potential technique (TDEP). It is based on \emph{ab initio} molecular dynamics followed by a mapping onto a model Hamiltonian that describes the lattice dynamics. The formalism and the numerical aspects of the technique are described in details. A number of practical examples are given, and results are presented, which confirm the usefulness of TDEP within \emph{ab initio} and classical molecular dynamics frameworks. In particular, we examine from first-principles the behavior of force constants upon the dynamical stabilization of body centered phase of Zr, and show that they become more localized. We also calculate phase diagram for $^4$He modeled with the Aziz \emph{et al.} potential and obtain results which are in favorable agreement both with respect to experiment and established techniques.

cond-mat.stat-mech↗

arXiv2013

Theoretical assessment on the possibility of constraining point defect energetics by pseudo-phase transition pressures

Making use of the energetics and equations of state of defective uranium dioxide that calculated with first-principles method, we demonstrate a possibility of constraining the formation energy of point defects by measuring the transition pressures of the corresponding pseudo-phase of defects. The mechanically stable range of fluorite structure of UO2, which dictates the maximum possible pressure of relevant pseudo-phase transitions, gives rise to defect formation energies that span a wide band and overlap with the existing experimental estimates. We reveal that the knowledge about pseudo-phase boundaries can not only provide important information of energetics that is helpful for reducing the scattering in current estimates, but also be valuable for guiding theoretical assessments, even to validate or disprove a theory. In order to take defect interactions into account and to extrapolate the physical quantities at finite stoichiometry deviations to that near the stoichiometry, we develop a general formalism to describe the thermodynamics of a defective system. We also show that it is possible to include interactions among defects in a simple expression of point defect model (PDM) by introducing an auxiliary constant mean-field. This generalization of the simple PDM leads to great versatility that allows one to study nonlinear effects of stoichiometry deviation on materials' behavior. It is a powerful tool to extract the defect energetics from finite defect concentrations to the dilute limit. Besides these, the full content of the theoretical formalism and some relevant and interesting issues, including reentrant pseudo-transition, multi-defect coexistence, charged defects, and possible consequence of instantaneous defective response in a quantum crystal, are explored and discussed.

cond-mat.mtrl-sci↗

arXiv2013

Monte Carlo simulations of the three-dimensional XY spin glass focusing on the chiral and the spin order

The ordering of the three-dimensional isotropic {\it XY} spin glass with the nearest-neighbor random Gaussian coupling is studied by extensive Monte Carlo simulations. To investigate the ordering of the spin and the chirality, we compute several independent physical quantities including the glass order parameter, the Binder parameter, the correlation-length ratio, the overlap distribution and the non-self-averageness parameter, {\it etc}, for both the spin-glass (SG) and the chiral-glass (CG) degrees of freedom. Evidence of the spin-chirality decoupling, {\it i.e.}, the CG and the SG order occurring at two separated temperatures, $0<T_{SG}<T_{CG}$, is obtained from the glass order parameter, which is fully corroborated by the Binder parameter. By contrast, the CG correlation-length ratio yields a rather pathological and inconsistent result in the range of sizes we studied, which may originate from the finite-size effect associated with a significant short-length drop-off of the spatial CG correlations. Finite-size-scaling analysis yields the CG exponents $ν_{CG}=1.36^{+0.15}_{-0.37}$ and $η_{CG}=0.26^{+0.29}_{-0.26}$, and the SG exponents $ν_{SG}=1.22^{+0.26}_{-0.06}$ and $η_{SG}=-0.54^{+0.24}_{-0.52}$. The obtained exponents are close to those of the Heisenberg SG, but are largely different from those of the Ising SG. The chiral overlap distribution and the chiral Binder parameter exhibit the feature of a continuous one-step replica-symmetry breaking (1RSB), consistently with the previous reports. Such a 1RSB feature is again in common with that of the Heisenberg SG, but is different from the Ising one, which may be the cause of the difference in the CG critical properties from the Ising SG ones despite of a common $Z_2$ symmetry.

cond-mat.dis-nn↗

arXiv2012

Time-integrated observables as order parameters for dynamical phase transitions in closed quantum systems

The dynamical behaviour of many-body systems is often richer than what can be anticipated from their static properties. Here we show that in closed quantum systems this becomes evident by considering time-integrated observables as order parameters. In particular, the analytic properties of their generating functions, as estimated by full-counting statistics, allow to identify dynamical phases, i.e. phases with specific fluctuation properties of time-integrated observables, and to locate the transitions between these phases. We discuss in detail the case of the quantum Ising chain in a transverse field. We show that this model displays a continuum of quantum dynamical transitions, of which the static transition is just an end point. These singularities are not a consequence of particular choices of initial conditions or other external non-equilibrium protocols such as quenches in coupling constants. They can be probed generically through quantum jump statistics of an associated open problem, and for the case of the quantum Ising chain we outline a possible experimental realisation of this scheme by digital quantum simulation with cold ions.

cond-mat.stat-mech↗

arXiv2013

Exact form of the exponential correlation function in the glassy super-rough phase

We consider the random-phase sine-Gordon model in two dimensions. It describes two-dimensional elastic systems with random periodic disorder, such as pinned flux-line arrays, random field XY models, and surfaces of disordered crystals. The model exhibits a super-rough glass phase at low temperature $T<T_{c}$ with relative displacements growing with distance $r$ as $\bar{\langle [θ(r)-θ(0)]^2\rangle} \simeq A(τ) \ln^2 (r/a)$, where $A(τ) = 2 τ^2- 2 τ^3 +\mathcal{O}(τ^4)$ near the transition and $τ=1-T/T_{c}$. We calculate all higher cumulants and show that they grow as $\bar{\langle[θ(r)-θ(0)]^{2n}\rangle}_c \simeq [2 (-1)^{n+1} (2n)! ζ(2n-1) τ^2 + \mathcal{O}(τ^3) ] \ln(r/a)$, $n \geq 2$, where $ζ$ is the Riemann zeta function. By summation, we obtain the decay of the exponential correlation function as $\bar{\langle e^{iq\left[θ(r)-θ(0)\right]}\rangle} \simeq (a/r)^{η(q)} \exp\boldsymbol(-\frac{1}{2}\mathcal{A}(q)\ln^2(r/a)\boldsymbol)$ where $η(q)$ and ${\cal A}(q)$ are obtained for arbitrary $q \leq 1$ to leading order in $τ$. The anomalous exponent is $η(q) = c q^2 - τ^2 q^2 [2γ_E+ψ(q)+ψ(-q)]$ in terms of the digamma function $ψ$, where $c$ is non-universal and $γ_E$ is the Euler constant. The correlation function shows a faster decay at $q=1$, corresponding to fermion operators in the dual picture, which should be visible in Bragg scattering experiments.

cond-mat.stat-mech↗

arXiv2013

Second-order phase transition in the Heisenberg model on a triangular lattice with competing interactions

We discover an example where the dissociation of the Z2 vortices occurs at the second-order phase transition point. We investigate the nature of phase transition in a classical Heisenberg model on a distorted triangular lattice with competing interactions. The order parameter space of the model is SO(3)xZ2. The dissociation of the Z2 vortices which comes from SO(3) and a second-order phase transition with Z2 symmetry breaking occur at the same temperature. We also find that the second-order phase transition belongs to the universality class of the two-dimensional Ising model.

cond-mat.stat-mech↗

arXiv2013

Linewidth of the electromagnetic radiation from Josephson junctions near cavity resonances

The powerful terahertz emission from intrinsic Josephson junctions in high-Tc cuprate superconductors has been detected recently. The synchronization of different junctions is enhanced by excitation of the geometrical cavity resonance. A key characteristic of the radiation is its linewidth. In this work, we study the intrinsic linewidth of the radiation near the internal cavity resonance. Surprisingly, this problem was never considered before, neither for a single Josephson junction nor for a stack of the intrinsic Josephson junctions realized in cuprate superconductors. The linewidth appears due to the slow phase diffusion, which is determined by the dissipation and amplitude of the noise. We found that both these parameters are resonantly enhanced when the cavity mode is excited but enhancement of the dissipation dominates leading to the net suppression of diffusion and dramatic narrowing of the linewidth. The line shape changes from Lorentzian to Gaussian when either the Josephson frequency is shifted away from the resonance or the temperature is increased.

cond-mat.supr-con↗

arXiv2013

Scaling, Finite Size Effects, and Crossovers of the Resistivity and Current-Voltage Characteristics in Two-Dimensional Superconductors

We revisit the scaling properties of the resistivity and the current-voltage characteristics at and below the Berezinskii-Kosterlitz-Thouless transition, both in zero and nonzero magnetic field. The scaling properties are derived by integrating the renormalization group flow equations up to a scale where they can be reliably matched to simple analytic expressions. The vortex fugacity turns out to be dangerously irrelevant for these quantities below Tc, thereby altering the scaling behavior. We derive the possible crossover effects as the current, magnetic field, or system size is varied, and find a strong multiplicative logarithmic correction near Tc, all of which is necessary to account for when interpreting experiments and simulation data. Our analysis clarifies a longstanding discrepancy between the finite size dependence found in many simulations and the current-voltage characteristics of experiments. We further show that the logarithmic correction can be avoided by approaching the transition in a magnetic field, thereby simplifying the scaling analysis. We confirm our results by large-scale numerical simulations, and calculate the dynamic critical exponent z, for relaxational Langevin dynamics and for resistively and capacitively shunted Josephson junction dynamics.

cond-mat.supr-con↗

arXiv2013

Scaling in reversible submonolayer deposition

The scaling of island and monomer density, capture zone distributions (CZDs), and island size distributions (ISDs) in reversible submonolayer growth was studied using the Clarke-Vvedensky model. An approach based on rate-equation results for irreversible aggregation (IA) models is extended to predict several scaling regimes in square and triangular lattices, in agreement with simulation results. Consistently with previous works, a regime I with fractal islands is observed at low temperatures, corresponding to IA with critical island size i=1, and a crossover to a second regime appears as the temperature is increased to εR^{2/3} ~ 1, where εis the single bond detachment probability and R is the diffusion-to-deposition ratio. In the square (triangular) lattice, a regime with scaling similar to IA with i=3 (i=2) is observed after that crossover. In the triangular lattice, a subsequent crossover to an IA regime with i=3 is observed, which is explained by the recurrence properties of random walks in two dimensional lattices, which is beyond the mean-field approaches. At high temperatures, a crossover to a fully reversible regime is observed, characterized by a large density of small islands, a small density of very large islands, and total island and monomer densities increasing with temperature, in contrast to IA models. CZDs and ISDs with Gaussian right tails appear in all regimes for R ~ 10^7 or larger, including the fully reversible regime, where the CZDs are bimodal. This shows that the Pimpinelli-Einstein (PE) approach for IA explains the main mechanisms for the large islands to compete for free adatom aggregation in the reversible model, and may be the reason for its successful application to a variety of materials and growth conditions.

cond-mat.stat-mech↗

arXiv2013

Reduced Density Matrix after a Quantum Quench

We consider the reduced density matrix (RDM) ρ_A(t) for a finite subsystem A after a global quantum quench in the infinite transverse-field Ising chain. It has been recently shown that the infinite time limit of ρ_A(t) is described by the RDM ρ_{GGE,A} of a generalized Gibbs ensemble. Here we present some details on how to construct this ensemble in terms of local integrals of motion, and show its equivalence to the expression in terms of mode occupation numbers widely used in the literature. We then address the question, how ρ_A(t) approaches ρ_{GGE,A} as a function of time. To that end we introduce a distance on the space of density matrices and show that it approaches zero as a universal power-law t^{-3/2} in time. As the RDM completely determines all local observables within A, this provides information on the relaxation of correlation functions of local operators. We then address the issue, of how well a truncated generalized Gibbs ensemble with a finite number of local higher conservation laws describes a given subsystem at late times. We find that taking into account only local conservation laws with a range at most comparable to the subsystem size provides a good description. However, excluding even a single one of the most local conservation laws in general completely spoils this agreement.

cond-mat.stat-mech↗

arXiv2013

Topological floating phase in a spatially anisotropic frustrated Ising model

We present new results for the ordering process of a two-dimensional Ising model with anisotropic frustrating next-nearest-neighbor interactions. We concentrate on a specific wide temperature and parameter region to confirm the existence of two particular phases of the model. The first phase is an incommensurate algebraically-ordered (floating) phase emerging at the transition from the paramagnetic high-temperature phase. Then the model undergoes a transition to an antiferromagnetically ordered second phase with diagonal ferromagnetic stripes (ordering wave vector $\vec q = (π/2, π/2)$). We analyze the unconventional features appearing in several observables, e.g., energy, structure factors, and correlation functions by means of extensive Monte-Carlo simulations and examine carefully the influence of the lattice sizes. For the analytical study of the intermediate phase the Villain-Bak theory is adapted for the present model. Combining both the numerical and analytical work we present the quantitative phase diagram of the model, and, in particular, argue in favor of an intermediate topological floating phase.

cond-mat.stat-mech↗

arXiv2013

Universal behavior of two-dimensional bosonic gases at Berezinskii-Kosterlitz-Thouless transitions

We study the universal critical behavior of two-dimensional (2D) lattice bosonic gases at the Berezinskii-Kosterlitz-Thouless (BKT) transition, which separates the low-temperature superfluid phase from the high-temperature normal phase. For this purpose, we perform quantum Monte Carlo simulations of the hard-core Bose-Hubbard (BH) model at zero chemical potential. We determine the critical temperature by using a matching method that relates finite-size data for the BH model with corresponding data computed in the classical XY model. In this approach, the neglected scaling corrections decay as inverse powers of the lattice size L, and not as powers of 1/lnL, as in more standard approaches, making the estimate of the critical temperature much more reliable. Then, we consider the BH model in the presence of a trapping harmonic potential, and verify the universality of the trap-size dependence at the BKT critical point. This issue is relevant for experiments with quasi-2D trapped cold atoms.

cond-mat.quant-gas↗

arXiv2013

Quantum entanglement entropy and classical mutual information in long-range harmonic oscillators

We study different aspects of quantum von Neumann and Rényi entanglement entropy of one dimensional long-range harmonic oscillators that can be described by well-defined non-local field theories. We show that the entanglement entropy of one interval with respect to the rest changes logarithmically with the number of oscillators inside the subsystem. This is true also in the presence of different boundary conditions. We show that the coefficients of the logarithms coming from different boundary conditions can be reduced to just two different universal coefficients. We also study the effect of the mass and temperature on the entanglement entropy of the system in different situations. The universality of our results is also confirmed by changing different parameters in the coupled harmonic oscillators. We also show that more general interactions coming from general singular Toeplitz matrices can be decomposed to our long-range harmonic oscillators. Despite the long-range nature of the couplings we show that the area law is valid in two dimensions and the universal logarithmic terms appear if we consider subregions with sharp corners. Finally we study analytically different aspects of the mutual information such as its logarithmic dependence to the subsystem, effect of mass and influence of the boundary. We also generalize our results in this case to general singular Toeplitz matrices and higher dimensions.

cond-mat.stat-mech↗

arXiv2013

Universal Renyi mutual information in classical systems: the case of kagome ice

We study the Renyi mutual information of classical systems characterized by a transfer matrix. We first establish a general relationship between the Renyi mutual information of such classical mixtures of configuration states, and the Renyi entropy of a corresponding Rokhsar-Kivelson--type quantum superposition. We then focus on chiral and nonchiral kagome-ice systems, classical spin liquids on the kagome lattice, which respectively have critical and short-range correlations. Through a mapping of the chiral kagome ice to the quantum Liftshitz critical field theory, we predict a universal subleading term in the Renyi mutual information of this classical spin liquid, which can be realized in the pyrochlore spin ice in a magnetic field. We verify our prediction with direct numerical transfer-matrix computations, and further demonstrate that the nonchiral kagome ice (and the corresponding quantum Rokhsar-Kivelson superposition) is a topologically trivial phase. Finally, we argue that the universal term in the mutual information of the chiral kagome ice is fragile against the presence of defects.

cond-mat.str-el↗

arXiv2013

On the nature of the phase transitions in two-dimensional type II superconductors

We have simulated the thermodynamics of vortices in a thin film of a type-II superconductor. We make the lowest Landau level approximation, and use quasi-periodic boundary conditions. Our work is consistent with the results of previous simulations where evidence was found for an apparent first order transition between the vortex liquid state and the vortex crystal state. We show, however, that these results are just an artifact of studying systems which are too small. There are substantial difficulties in simulating larger systems using traditional approaches. By means of the optimal energy diffusion algorithm we have been able to study systems containing up to about one thousand vortices, and for these larger systems the evidence for a first order transition disappears. By studying both crystalline and hexatic order, we show that the KTHNY scenario seems to apply, where melting from the crystal is first to the hexatic liquid state and next to the normal vortex liquid, in both cases via a continuous transition.

cond-mat.supr-con↗