Single-parameter aging in a binary Lennard-Jones system

This paper studies physical aging by computer simulations of a 2:1 Kob-Andersen binary Lennard-Jones mixture, a system that is less prone to crystallization than the standard 4:1 composition. Starting from thermal-equilibrium states, the time evolution of the following four quantities is monitored by following up and down jumps in temperature: potential energy, virial, average squared force, and the Laplacian of the potential energy. Despite the fact that significantly larger temperature jumps are studied here than in typical similar experiments, to a good approximation, all four quantities conform to the single-parameter-aging scenario derived and validated for small jumps in experiments [T. Hecksher, N. B. Olsen, and J. C. Dyre, J. Chem. Phys. 142, 241103 (2015)]. As a further confirmation of single-parameter aging with a common material time for the four different quantities monitored, their relaxing parts are found to be almost identical for all temperature jumps.

Automated summary

This study investigates physical aging through computer simulations of a 2:1 Kob-Andersen binary Lennard-Jones mixture. Despite significantly larger temperature jumps being studied, the four quantities monitored conform to a single-parameter aging scenario derived from experiments. The relaxing parts of these quantities are almost identical for all temperature jumps, confirming a common material time for aging.