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Grzegorz Szamel

Publications and source records attributed to Grzegorz Szamel.

At least 73 records · Page 4Linked to original sources
arXiv2015

Fundamental differences between glassy dynamics in two and three dimensions

The two-dimensional freezing transition is very different from its three-dimensional counterpart. In contrast, the glass transition is usually assumed to have similar characteristics in two and three dimensions. Using computer simulations we show that glassy dynamics in supercooled two- and three-dimensional fluids are fundamentally different. Specifically, transient localization of particles upon approaching the glass transition is absent in two dimensions, whereas it is very pronounced in three dimensions. Moreover, the temperature dependence of the relaxation time of orientational correlations is decoupled from that of the translational relaxation time in two dimensions but not in three dimensions. Lastly, the relationships between the characteristic size of dynamically heterogeneous regions and the relaxation time are very different in two and three dimensions. These results strongly suggest that the glass transition in two dimensions is different than in three dimensions.

cond-mat.soft↗
arXiv2015

Cooling-rate dependence of kinetic and mechanical stability of simulated glasses

Recently, ultrastable glasses have been created through vapor deposition. Subsequently, computer simulation algorithms have been proposed that mimic the vapor deposition process and result in simulated glasses with increased stability. In addition, random pinning has been used to generate very stable glassy configurations without the need for lengthy annealing or special algorithms inspired by vapor deposition. Kinetic and mechanical stability of experimental ultrastable glasses is compared to those of experimental glasses formed by cooling. We provide the basis for a similar comparison for simulated stable glasses: we analyze the kinetic and mechanical stability of simulated glasses formed by cooling at a constant rate by examining the transformation time to a liquid upon rapid re-heating, the inherent structure energies, and the shear modulus. The kinetic and structural stability increases slowly with decreasing cooling rate. The methods outlined here can be used to assess kinetic and mechanical stability of simulated glasses generated by using specialized algorithms.

cond-mat.soft↗
arXiv2014

Long-range spatial correlations of particle displacements and the emergence of elasticity

We examine correlations of transverse particle displacements and their relationship to the shear modulus of a glass and the viscosity of a fluid. To this end we use computer simulations to calculate a correlation function of the displacements, $S_4(q;t)$, which is similar to functions used to study heterogeneous dynamics in glass-forming fluids. We show that in the glass the shear modulus can be obtained from the long-time, small-q limit of $S_4(q;t)$. By using scaling arguments, we argue that a four-point correlation length $ξ_4(t)$ grows linearly in time in a glass and grows as $\sqrt{t}$ at long times in a fluid, and we verify these results by analyzing $S_4(q;t)$ obtained from simulations. For a viscoelastic fluid, the simulation results suggest that the crossover to the long-time $\sqrt{t}$ growth of $ξ_4(t)$ occurs at a characteristic decay time of the shear stress autocorrelation function. Using this observation, we show that the amplitude of the long-time $\sqrt{t}$ growth is proportional to $\sqrtη$ where $η$ is the viscosity of the fluid.

cond-mat.stat-mech↗
arXiv2014

A self-propelled particle in an external potential: is there an effective temperature?

We study a stationary state of a single self-propelled, athermal particle in linear and quadratic external potentials. The self-propulsion is modeled as a fluctuating force evolving according to the Ornstein-Uhlenbeck process, independently of the state of the particle. Without an external potential, in the long time limit, the self-propelled particle moving in a viscous medium performs diffusive motion, which allows one to identify an effective temperature. We show that in the presence of a linear external potential the stationary state distribution has an exponential form with the sedimentation length determined by the effective temperature of the free self-propelled particle. In the presence of a quadratic external potential the stationary state distribution has a Gaussian form. However, in general, this distribution is not determined by the effective temperature of the free self-propelled particle.

cond-mat.soft↗
arXiv2013

Universal features of dynamic heterogeneity in supercooled liquids

A few years ago it was showed that some systems that have very similar local structure, as quantified by the pair correlation function, exhibit vastly different slowing down upon supercooling [L. Berthier and G. Tarjus, Phys. Rev. Lett. 103, 170601 (2009); U.R. Pedersen, T.B. Schroder and J.C. Dyre, Phys. Rev. Lett. 105, 157801 (2010)]. Recently, a more subtle structural quantity, the so-called "point-to-set" length, was found to reliably correlate with the average dynamics [G.M. Hocky, T.E. Markland and D.R. Reichman, Phys. Rev. Lett. 108, 225506 (2012)]. Here we use computer simulations to examine the behavior of fluctuations around the average dynamics, i.e., dynamic heterogeneity. We study five model glass-forming liquids: three model liquids used in previous works and two additional model liquids with finite range interactions. Some of these systems have very similar local structure but vastly different dynamics. We show that for all these systems the spatial extent and the anisotropy of dynamic heterogeneity correlate very well with the average dynamics.

cond-mat.soft↗
arXiv2013

Breakdown of a renormalized perturbation expansion around mode-coupling theory of the glass transition

We analyze a renormalized perturbation expansion around the mode-coupling theory of the glass transition. We focus on the long-time limit of the irreducible memory function. We discuss a renormalized diagrammatic expansion for this function and re-sum two infinite classes of diagrams. We show that the resulting contributions to the irreducible memory function diverge at the mode-coupling transition. A further re-summation of ladder diagrams constructed by iterating these divergent contributions gives a finite result which cancels the mode-coupling theory's expression for the irreducible memory function.

cond-mat.stat-mech↗
arXiv2012

Dynamic heterogeneities above and below the mode-coupling temperature. Evidence of a dynamic crossover

We examine dynamic heterogeneities in a model glass-forming fluid, a binary harmonic sphere mixture, above and below the mode-coupling temperature T_c. We calculate the ensemble independent susceptibility chi_4(tau_alpha) and the dynamic correlation length xi_4(tau_alpha) at the alpha-relaxation time tau_alpha. We also examine in detail the temperature dependence of tau_alpha and the diffusion coefficient D. For higher temperatures we find that the standard Stokes-Einstein relationship, D ~ tau_alpha^{-1}, holds, but at lower temperatures a fractional Stokes-Einstein relationship, D ~ tau_alpha^{-sigma} with sigma = 0.65, emerges. By examining the relationships between tau_alpha, D, chi_4(tau_alpha), and xi_4(tau_alpha) we determine that the emergence of the fractional Stokes-Einstein relationship is accompanied by a dynamic crossover from tau_alpha ~ e^{k_2 xi_4} at higher temperatures to tau_alpha ~ e^{k_1 xi_4^{3/2}} at lower temperatures.

cond-mat.stat-mech↗
arXiv2012

Mode-coupling theory and beyond: a diagrammatic approach

For almost thirty years, mode-coupling theory has been the most widely discussed and used but also the most controversial theory of the glass transition. In this paper we briefly review the reasons for both its popularity and its controversy. We emphasize the need for the development of approaches that would be able to evaluate corrections to and extensions of the existing (standard) mode-coupling theory. Next, we review our diagrammatic formulation of the dynamics of interacting Brownian particles. We show that within this approach the standard mode-coupling theory can be derived in a very simple way. Finally, we use our diagrammatic approach to calculate two corrections to the mode-coupling theory's expression for the so-called irreducible memory function. These corrections involve re-summations of well defined classes of non-mode-coupling diagrams.

cond-mat.stat-mech↗
arXiv2012

Glassy dynamics of partially pinned fluids: an alternative mode-coupling approach

We use a simple mode-coupling approach to investigate glassy dynamics of partially pinned fluid systems. Our approach is different from the mode-coupling theory developed by Krakoviack [Phys. Rev. Lett. 94, 065703 (2005), Phys. Rev. E 84, 050501(R) (2011)]. In contrast to Krakoviack's theory, our approach predicts a random pinning glass transition scenario that is qualitatively the same as the scenario obtained using a mean-field analysis of the spherical p-spin model and a mean-field version of the random first-order transition theory. We use our approach to calculate quantities which are often considered to be indicators of growing dynamic correlations and static point-to-set correlations. We find that the so-called static overlap is dominated by the simple, low pinning fraction contribution. Thus, at least for randomly pinned fluid systems, only a careful quantitative analysis of simulation results can reveal genuine, many-body point-to-set correlations.

cond-mat.dis-nn↗
arXiv2011

Tagged particle in a sheared suspension: effective temperature determines density distribution in a slowly varying external potential beyond linear response

We consider a sheared colloidal suspension under the influence of an external potential that varies slowly in space in the plane perpendicular to the flow and acts on one selected (tagged) particle of the suspension. Using a Chapman-Enskog type expansion we derive a steady state equation for the tagged particle density distribution. We show that for potentials varying along one direction only, the tagged particle distribution is the same as the equilibrium distribution with the temperature equal to the effective temperature obtained from the violation of the Einstein relation between the self-diffusion and tagged particle mobility coefficients. We thus prove the usefulness of this effective temperature for the description of the tagged particle behavior beyond the realm of linear response. We illustrate our theoretical predictions with Brownian dynamics computer simulations.

cond-mat.soft↗
arXiv2011

Effective temperatures of a driven, strongly anisotropic Brownian system

We use Brownian Dynamics computer simulations of a moderately dense colloidal system undergoing steady shear flow to investigate the uniqueness of the so-called effective temperature. We compare effective temperatures calculated from the fluctuation-dissipation ratios and from the linear response to a static, long wavelength, external perturbation along two directions: the shear gradient direction and the vorticity direction. At high shear rates, when the system is strongly anisotropic, the fluctuation-dissipation ratio derived effective temperatures are approximately wave-vector independent, but the temperatures along the gradient direction are somewhat higher than those along the vorticity direction. The temperatures derived from the static linear response show the same dependence on the direction as those derived from the fluctuation-dissipation ratio. However, the former and the latter temperatures are different. Our results suggest that the presently used formulae for effective temperatures may not be applicable for strongly anisotropic, driven systems.

cond-mat.soft↗
arXiv2011

Emergence of Long-range Correlations and Rigidity at the Dynamic Glass Transition

At the microscopic level, equilibrium liquid's translational symmetry is spontaneously broken at the so-called dynamic glass transition predicted by the mean-field replica approach. We show that this fact implies the emergence of Goldstone modes and long-range density correlations. We derive and evaluate a new statistical mechanical expression for the glass shear modulus.

cond-mat.stat-mech↗
arXiv2011

Analysis of a growing dynamic length scale in a glass-forming binary hard-sphere mixture

We examine a length scale that characterizes the spatial extent of heterogeneous dynamics in a glass-forming binary hard-sphere mixture up to the mode-coupling volume fraction phi_c. First, we characterize the system's dynamics. Then, we utilize a new method [Phys. Rev. Lett. 105, 217801 (2010)] to extract and analyze the ensemble independent dynamic susceptibility chi_4(t) and the dynamic correlation length xi(t) for a range of times between the beta and alpha relaxation times. We find that in this time range the dynamic correlation length follows a volume fraction independent curve xi(t) ~ ln(t). For longer times, xi(t) departs from this curve and remains constant up to the largest time at which we can determine the length accurately. In addition to the previously established correlation tau_alpha ~ exp[xi(tau_alpha)] between the alpha relaxation time, tau_alpha, and the dynamic correlation length at this time, xi(tau_alpha), we also find a similar correlation for the diffusion coefficient D ~ exp[xi(tau_alpha)^theta] with theta approximately 0.6. We discuss the relevance of these findings for different theories of the glass transition.

cond-mat.soft↗
arXiv2010

Dynamic heterogeneity in a glass forming fluid: susceptibility, structure factor and correlation length

We investigate the growth of dynamic heterogeneity in a glassy hard-sphere mixture for volume fractions up to and including the mode-coupling transition. We use an 80 000 particle system to test a new procedure to evaluate a dynamic correlation length xi(t): we determine the ensemble independent dynamic susceptibility chi_4(t) and use it to facilitate evaluation of xi(t) from the small wave vector behavior of the four-point structure factor. We analyze relations between the alpha relaxation time tau_alpha, chi_4(tau_alpha), and xi(tau_alpha). We find that mode-coupling like power laws provide a reasonable description of the data over a restricted range of volume fractions, but the power laws' exponents differ from those predicted by the inhomogeneous mode-coupling theory. We find xi(tau_alpha) ~ ln(tau_alpha) over the full range of volume fractions studied, which is consistent with Adams-Gibbs-type relation.

cond-mat.soft↗
arXiv2010

Increasing the density melts ultrasoft colloidal glasses

We use theory and simulations to investigate the existence of amorphous glassy states in ultrasoft colloids. We combine the hyper-netted chain approximation with mode-coupling theory to study the dynamic phase diagram of soft repulsive spheres interacting with a Hertzian potential, focusing on low temperatures and large densities. At constant temperature, we find that an amorphous glassy state is entered upon compression, as in colloidal hard spheres, but the glass unexpectedly melts when density increases further. We attribute this re-entrant fluid-glass transition to particle softness, and correlate this behaviour to previously reported anomalies in soft systems, thus emphasizing its generality. The predicted fluid-glass-fluid sequence is confirmed numerically.

cond-mat.soft↗
arXiv2010

Dynamic glass transition: bridging the gap between mode-coupling theory and the replica approach

We clarify the relation between the ergodicity breaking transition predicted by mode-coupling theory and the so-called dynamic transition predicted by the static replica approach. Following Franz and Parisi [Phys. Rev. Lett. 79, 2486 (1997)], we consider a system of particles in a metastable state characterized by non-trivial correlations with a quenched configuration. We show that the assumption that in a metastable state particle currents vanish leads to an expression for the replica off-diagonal direct correlation function in terms of a replica off-diagonal static four-point correlation function. A factorization approximation for this function results in an approximate closure for the replica off-diagonal direct correlation function. The replica off-diagonal Ornstein-Zernicke equation combined with this closure coincides with the equation for the non-ergodicity parameter derived using the mode-coupling theory.

cond-mat.stat-mech↗
arXiv2009

Scaling of the glassy dynamics of soft repulsive particles: a mode-coupling approach

We combine the hyper-netted chain approximation of liquid state theory with the mode-coupling theory of the glass transition to analyze the structure and dynamics of soft spheres interacting via harmonic repulsion. We determine the locus of the fluid-glass dynamic transition in a temperature -- volume fraction phase diagram. The zero-temperature (hard sphere) glass transition influences the dynamics at finite temperatures in its vicinity. This directly implies a form of dynamic scaling for both the average relaxation time and dynamic susceptibilities quantifying dynamic heterogeneity. We discuss several qualitative disagreements between theory and existing simulations at equilibrium. Our theoretical results are, however, very similar to numerical results for the driven athermal dynamics of repulsive spheres, suggesting that `mean-field' mode-coupling approaches might be good starting points to describe these nonequilibrium dynamics.

cond-mat.stat-mech↗