Benjamin Guiselin, Ludovic Berthier, Gilles Tarjus
SciPost Phys. 12, 091 (2022) ·
published 14 March 2022
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We study the statistical mechanics of supercooled liquids when the system evolves at a temperature $T$ with a field $\epsilon$ linearly coupled to its overlap with a reference configuration of the same liquid sampled at a temperature $T_0$. We use mean-field theory to fully characterize the influence of the reference temperature $T_0$, and we mainly study the case of a fixed, low-$T_0$ value in computer simulations. We numerically investigate the extended phase diagram in the $(\epsilon,T)$ plane of model glass-forming liquids in spatial dimensions $d=2$ and $d=3$, relying on umbrella sampling and reweighting techniques. For both $2d$ and $3d$ cases, a similar phenomenology with nontrivial thermodynamic fluctuations of the overlap is observed at low temperatures, but a detailed finite-size analysis reveals qualitatively distinct behaviors. We establish the existence of a first-order transition line for nonzero $\epsilon$ ending in a critical point in the universality class of the random-field Ising model (RFIM) in $d=3$. In $d=2$ instead, no phase transition is found in large enough systems at least down to temperatures below the extrapolated calorimetric glass transition temperature $T_g$. Our results confirm that glass-forming liquid samples of limited size display the thermodynamic fluctuations expected for finite systems undergoing a random first-order transition. They also support the relevance of the physics of the RFIM for supercooled liquids, which may then explain the qualitative difference between $2d$ and $3d$ glass-formers.
Daniele Coslovich, Andrea Ninarello, Ludovic Berthier
SciPost Phys. 7, 077 (2019) ·
published 6 December 2019
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We study the equilibrium statistical properties of the potential energy landscape of several glass models in a temperature regime so far inaccessible to computer simulations. We show that unstable modes of the stationary points undergo a localization transition in real space close to the mode-coupling crossover temperature determined from the dynamics. The concentration of localized unstable modes found at low temperature is a non-universal, finite dimensional feature not captured by mean-field glass theory. Our analysis reconciles, and considerably expands, previous conflicting numerical results and provides a characteristic temperature for glassy dynamics that unambiguously locates the mode-coupling crossover.
SciPost Phys. 3, 027 (2017) ·
published 12 October 2017
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We numerically study the jamming transition of frictionless polydisperse spheres in three dimensions. We use an efficient thermalisation algorithm for the equilibrium hard sphere fluid and generate amorphous jammed packings over a range of critical jamming densities that is about three times broader than in previous studies. This allows us to reexamine a wide range of structural properties characterizing the jamming transition. Both isostaticity and the critical behavior of the pair correlation function hold over the entire range of jamming densities. At intermediate length scales, we find a weak, smooth increase of bond orientational order. By contrast, distorted icosahedral structures grow rapidly with increasing the volume fraction in both fluid and jammed states. Surprisingly, at large scale we observe that denser jammed states show stronger deviations from hyperuniformity, suggesting that the enhanced amorphous ordering inherited from the equilibrium fluid competes with, rather than enhances, hyperuniformity. Finally, finite size fluctuations of the critical jamming density are considerably suppressed in the denser jammed states, indicating an important change in the topography of the potential energy landscape. By considerably stretching the amplitude of the critical "J-line", our work disentangles physical properties at the contact scale that are associated with jamming criticality, from those occurring at larger length scales, which have a different nature.
