1. Structural relaxation, dynamical arrest, and aging in soft-sphere liquids.
- Author
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Mendoza-Méndez, P., Peredo-Ortiz, R., Lázaro-Lázaro, E., Chávez-Paez, M., Ruiz-Estrada, H., Pacheco-Vázquez, F., Medina-Noyola, M., and Elizondo-Aguilera, L. F.
- Subjects
LANGEVIN equations ,GLASS transitions ,LIQUIDS ,ARREST - Abstract
We investigate the structural relaxation of a soft-sphere liquid quenched isochorically (ϕ = 0.7) and instantaneously to different temperatures T
f above and below the glass transition. For this, we combine extensive Brownian dynamics simulations and theoretical calculations based on the non-equilibrium self-consistent generalized Langevin equation (NE-SCGLE) theory. The response of the liquid to a quench generally consists of a sub-linear increase of the α-relaxation time with system's age. Approaching the ideal glass-transition temperature from above (Tf > Ta ), sub-aging appears as a transient process describing a broad equilibration crossover for quenches to nearly arrested states. This allows us to empirically determine an equilibration timescale teq (Tf ) that becomes increasingly longer as Tf approaches Ta . For quenches inside the glass (Tf ≤ Ta ), the growth rate of the structural relaxation time becomes progressively larger as Tf decreases and, unlike the equilibration scenario, τα remains evolving within the whole observation time-window. These features are consistently found in theory and simulations with remarkable semi-quantitative agreement and coincide with those revealed in a previous and complementary study [P. Mendoza-Méndez et al., Phys. Rev. 96, 022608 (2017)] that considered a sequence of quenches with fixed final temperature Tf = 0 but increasing ϕ toward the hard-sphere dynamical arrest volume fraction ϕ H S a = 0.582. The NE-SCGLE analysis, however, unveils various fundamental aspects of the glass transition, involving the abrupt passage from the ordinary equilibration scenario to the persistent aging effects that are characteristic of glass-forming liquids. The theory also explains that, within the time window of any experimental observation, this can only be observed as a continuous crossover. [ABSTRACT FROM AUTHOR]- Published
- 2022
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