Two-Dimensional Melting of Two- and Three-Component Mixtures.

We elucidate the interplay between diverse two-dimensional melting pathways and establish solid-hexatic and hexatic-liquid transition criteria via the numerical simulations of the melting transition of two- and three-component mixtures of hard polygons and disks. We show that a mixture's melting pathway may differ from its components and demonstrate eutectic mixtures that crystallize at a higher density than their pure components. Comparing the melting scenario of many two- and three-component mixtures, we establish universal melting criteria: the solid and hexatic phases become unstable as the density of topological defects, respectively, overcomes ρ_{d,s}≃0.046 and ρ_{d,h}≃0.123.

Local Plastic Response and Slow Heterogeneous Dynamics of Supercooled Liquids.

We demonstrate, via numerical simulations, that the relaxation dynamics of supercooled liquids correlates well with a plastic length scale measuring a particle's response to impulsive localized perturbations and weakly to measures of local elasticity. We find that the particle averaged plastic length scale vanishes linearly in temperature and controls the super-Arrhenius temperature dependence of the relaxation time. Furthermore, we show that the plastic length scale of individual particles correlates with their typical displacement at the relaxation time. In contrast, the local elastic response only correlates with the dynamics on the vibrational timescale.

Unifying Description of the Vibrational Anomalies of Amorphous Materials.

The vibrational density of states D(ω) of solids controls their thermal and transport properties. In crystals, the low-frequency modes are extended phonons distributed in frequency according to Debye's law, D(ω)∝ω^{2}. In amorphous solids, phonons are damped, and at low frequency D(ω) comprises extended modes in excess over Debye's prediction, leading to the so-called boson peak in D(ω)/ω^{2} at ω_{bp}, and quasilocalized ones. Here we show that boson peak and phonon attenuation in the Rayleigh scattering regime are related, as suggested by correlated fluctuating elasticity theory, and that amorphous materials can be described as homogeneous isotropic elastic media punctuated by quasilocalized modes acting as elastic heterogeneities. Our numerical results resolve the conflict between theoretical approaches attributing amorphous solids' vibrational anomalies to elastic disorder and localized defects.

Unconventional rheological properties in systems of deformable particles.

We demonstrate the existence of unconventional rheological and memory properties in systems of soft-deformable particles whose energy depends on their shape, via numerical simulations. At large strains, these systems experience an unconventional shear weakening transition characterized by an increase in the mechanical energy and a drastic drop in shear stress, which stems from the emergence of short-ranged tetratic order. In these weakened states, the contact network evolves reversibly under strain reversal, keeping memory of its initial state, while the microscopic dynamics is irreversible.

Role of Attractive Forces in the Relaxation Dynamics of Supercooled Liquids.

The attractive tail of the intermolecular interaction affects very weakly the structural properties of liquids, while it affects dramatically their dynamical ones. Via the numerical simulations of model systems not prone to crystallization, both in three and in two spatial dimensions, here we demonstrate that the nonperturbative dynamical effects of the attractive forces are tantamount to a rescaling of the activation energy by the glass transition temperature T_{g}: systems only differing in their attractive interaction have the same structural and dynamical properties if compared at the same value of T/T_{g}.

Attraction Tames Two-Dimensional Melting: From Continuous to Discontinuous Transitions.

Two-dimensional systems may admit a hexatic phase and hexatic-liquid transitions of different natures. The determination of their phase diagrams proved challenging, and indeed, those of hard disks, hard regular polygons, and inverse power-law potentials have only recently been clarified. In this context, the role of attractive forces is currently speculative, despite their prevalence at both the molecular and colloidal scale. Here, we demonstrate, via numerical simulations, that attraction promotes a discontinuous melting scenario with no hexatic phase. At high-temperature, Lennard-Jones particles and attractive polygons follow the shape-dominated melting scenario observed in hard disks and hard polygons, respectively. Conversely, all systems melt via a first-order transition with no hexatic phase at low temperature, where attractive forces dominate. The intermediate temperature melting scenario is shape dependent. Our results suggest that, in colloidal experiments, the tunability of the strength of the attractive forces allows for the observation of different melting scenarios in the same system.

Transition from Static to Dynamic Friction in an Array of Frictional Disks.

The nature of an instability that controls the transition from static to dynamical friction is studied in the context of an array of frictional disks that are pressed from above on a substrate. In this case the forces are all explicit and Newtonian dynamics can be employed without any phenomenological assumptions. We show that an oscillatory instability that had been discovered recently is responsible for the transition, allowing individual disks to spontaneously reach the Coulomb limit and slide with dynamic friction. The transparency of the model allows a full understanding of the phenomenon, including the speeds of the waves that travel from the trailing to the leading edge and vice versa.

Hyperuniformity and density fluctuations at a rigidity transition in a model of biological tissues.

The suppression of density fluctuations at different length scales is the hallmark of hyperuniformity. Here, we explore the presence of this hidden order in a manybody interacting model of biological tissue, known to exhibit a transition, or sharp crossover, from a solid to a fluid like phase. We show that the density fluctuations in the rigid phase are only suppressed up to a finite lengthscale. This length scale monotonically increases and grows rapidly as we approach the fluid phase reminiscent to divergent behavior at a critical point, such that the system is effectively hyperuniform in the fluid phase. Furthermore, complementary behavior of the structure factor across the critical point also indicates that hyperuniformity found in the fluid phase is stealthy.

Particle jumps in structural glasses.

Particles in structural glasses rattle around temporary equilibrium positions, that seldom change through a process which is much faster than the relaxation time, known as particle jump. Since the relaxation of the system is due to the accumulation of many such jumps, it could be possible to connect the single particle short time motion to the macroscopic relaxation by understanding the features of the jump dynamics. Here we review recent results in this research direction, clarifying the features of particle jumps that have been understood and those that are still under investigation, and examining the role of particle jumps in different theories of the glass transition.

Spatial correlations of elementary relaxation events in glass-forming liquids.

The dynamical facilitation scenario, by which localized relaxation events promote nearby relaxation events in an avalanche process, has been suggested as the key mechanism connecting the microscopic and the macroscopic dynamics of structural glasses. Here we investigate the statistical features of this process via numerical simulations of a model structural glass. First we show that the relaxation dynamics of the system occurs through particle jumps that are irreversible, and that cannot be decomposed in smaller irreversible events. Then we show that each jump does actually trigger an avalanche. The characteristics of this avalanche change upon cooling, suggesting that the relaxation dynamics crossovers from a noise dominated regime, where jumps do not trigger other relaxation events, to a regime dominated by the facilitation process, where a jump triggers more relaxation events.

Size and density avalanche scaling near jamming.

The current microscopic picture of plasticity in amorphous materials assumes local failure events to produce displacement fields complying with linear elasticity. Indeed, the flow properties of nonaffine systems, such as foams, emulsions and granular materials close to jamming, that produce a fluctuating displacement field when failing, are still controversial. Here we show, via a thorough numerical investigation of jammed materials, that nonaffinity induces a critical scaling of the flow properties dictated by the distance to the jamming point. We rationalize this critical behavior by introducing a new universal jamming exponent and hyperscaling relationships, and we use these results to describe the volume fraction dependence of the friction coefficient.

From cage-jump motion to macroscopic diffusion in supercooled liquids.

The evaluation of the long term stability of a material requires the estimation of its long-time dynamics. For amorphous materials such as structural glasses, it has proven difficult to predict the long-time dynamics starting from static measurements. Here we consider how long one needs to monitor the dynamics of a structural glass to predict its long-time features. We present a detailed characterization of the statistical features of the single-particle intermittent motion, and show that single-particle jumps are the irreversible events leading to the relaxation of the system. This allows us to evaluate the diffusion constant on the time-scale of the jump duration, which is small and temperature independent, i.e. well before the system enters the diffusive regime. The prediction is obtained by analyzing the particle trajectories via a parameter-free algorithm.

Dynamical arrest: interplay of glass and gel transitions.

The structural arrest of a polymeric suspension might be driven by an increase of the cross-linker concentration, which drives the gel transition, as well as by an increase of the polymer density, which induces a glass transition. These dynamical continuous (gel) and discontinuous (glass) transitions might interfere, since the glass transition might occur within the gel phase, and the gel transition might be induced in a polymer suspension with glassy features. Here we study the interplay of these transitions by investigating via event-driven molecular dynamics simulation the relaxation dynamics of a polymeric suspension as a function of the cross-linker concentration and the monomer volume fraction. We show that the slow dynamics within the gel phase is characterized by a long sub-diffusive regime, which is due both to the crowding as well as to the presence of a percolating cluster. In this regime, the transition of structural arrest is found to occur either along the gel or along the glass line, depending on the length scale at which the dynamics is probed. Where the two lines meet there is no apparent sign of higher order dynamical singularity. Logarithmic behavior typical of A3 singularity appears inside the gel phase along the glass transition line. These findings seem to be related to the results of the mode coupling theory for the F13 schematic model.

Interplay between jamming and motility-induced phase separation in persistent self-propelling particles.

In living and engineered systems of active particles, self-propulsion induces an unjamming transition from a solid to a fluid phase and phase separation between a gas and a liquidlike phase. We demonstrate an interplay between these two nonequilibrium transitions in systems of persistent active particles. The coexistence and jamming lines in the activity-density plane meet at the jamming transition point in the limit of hard particles or zero activity. This interplay induces an anomalous dynamic in the liquid phase and hysteresis at the active jamming transition.

Entropy-Driven Thermo-gelling Vitrimer.

Thermo-gelling polymers have been envisioned as promising smart biomaterials but limited by their weak mechanical and thermodynamic stabilities. Here, we propose a new thermo-gelling vitrimer, which remains at a liquid state because of the addition of protector molecules preventing the crosslinking, and with increasing temperature, an entropy-driven crosslinking occurs to induce the sol-gel transition. Moreover, we find that the activation barrier in the metathesis reaction of vitrimers plays an important role, and experimentally, one can use catalysts to tune the activation barrier to drive the vitrimer to form an equilibrium gel at high temperature, which is not subject to any thermodynamic instability. We formulate a mean-field theory to describe the entropy-driven crosslinking of the vitrimer, which agrees quantitatively with computer simulations and paves the way for the design and fabrication of novel vitrimers for biomedical applications.

Dynamical correlation length and relaxation processes in a glass former.

We investigate the relaxation process and the dynamical heterogeneities of the kinetically constrained Kob-Andersen lattice glass model and show that these are characterized by different time scales. The dynamics is well described within the diffusing defect paradigm, which suggests that we relate the relaxation process to a reverse-percolation transition. This allows for a geometrical interpretation of the relaxation process and of the different time scales.

Emergence of linear isotropic elasticity in amorphous and polycrystalline materials.

We investigate the emergence of isotropic linear elasticity in amorphous and polycrystalline solids via extensive numerical simulations. We show that the elastic properties are correlated over a finite length scale ξ_{E}, so that the central limit theorem dictates the emergence of continuum linear isotropic elasticity on increasing the specimen size. The stiffness matrix of systems of finite size L>ξ_{E} is obtained, adding to that predicted by linear isotropic elasticity a random one of spectral norm (L/ξ_{E})^{-3/2} in three spatial dimensions. We further demonstrate that the elastic length scale corresponds to that of structural correlations, which in polycrystals reflect the typical size of the grain boundaries and length scales characterizing correlations in the stress field. We finally demonstrate that the elastic length scale affects the decay of the anisotropic long-range correlations of locally defined shear modulus and shear stress.

Mechanical disorder of sticky-sphere glasses. II. Thermomechanical inannealability.

Many structural glasses feature static and dynamic mechanical properties that can depend strongly on glass formation history. The degree of universality of this history dependence and what it is possibly affected by are largely unexplored. Here we show that the variability of elastic properties of simple computer glasses under thermal annealing depends strongly on the strength of attractive interactions between the glasses' constituent particles-referred to here as glass "stickiness." We find that in stickier glasses the stiffening of the shear modulus with thermal annealing is strongly suppressed, while the thermal-annealing-induced softening of the bulk modulus is enhanced. Our key finding is that the characteristic frequency and density per frequency of soft quasilocalized modes becomes effectively invariant to annealing in very sticky glasses; the latter are therefore deemed "thermomechanically inannealable." The implications of our findings and future research directions are discussed.

Softness, anomalous dynamics, and fractal-like energy landscape in model cell tissues.

Epithelial cell tissues have a slow relaxation dynamics resembling that of supercooled liquids. Yet, they also have distinguishing features. These include an extended short-time subdiffusive transient, as observed in some experiments and recent studies of model systems, and a sub-Arrhenius dependence of the relaxation time on temperature, as reported in numerical studies. Here we demonstrate that the anomalous glassy dynamics of epithelial tissues originates from the emergence of a fractal-like energy landscape, particles becoming virtually free to diffuse in specific phase space directions up to a small distance. Furthermore, we clarify that the stiffness of the cells tunes this anomalous behavior, tissues of stiff cells having conventional glassy relaxation dynamics.

Mechanical disorder of sticky-sphere glasses. I. Effect of attractive interactions.

Recent literature indicates that attractive interactions between particles of a dense liquid play a secondary role in determining its bulk mechanical properties. Here we show that, in contrast with their apparent unimportance to the bulk mechanics of dense liquids, attractive interactions can have a major effect on macro- and microscopic elastic properties of glassy solids. We study several broadly applicable dimensionless measures of stability and mechanical disorder in simple computer glasses, in which the relative strength of attractive interactions-referred to as "glass stickiness"-can be readily tuned. We show that increasing glass stickiness can result in the decrease of various quantifiers of mechanical disorder, on both macro- and microscopic scales, with a pair of intriguing exceptions to this rule. Interestingly, in some cases strong attractions can lead to a reduction of the number density of soft, quasilocalized modes, by up to an order of magnitude, and to a substantial decrease in their core size, similar to the effects of thermal annealing on elasticity observed in recent works. Contrary to the behavior of canonical glass models, we provide compelling evidence indicating that the stabilization mechanism in our sticky-sphere glasses stems predominantly from the self-organized depletion of interactions featuring large, negative stiffnesses. Finally, we establish a fundamental link between macroscopic and microscopic quantifiers of mechanical disorder, which we motivate via scaling arguments. Future research directions are discussed.