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Finite-size effects in the diffusion dynamics of a glass-forming binary mixture with large size ratio
Vinay Vaibhav1, Jürgen Horbach2, Pinaki Chaudhuri1
1The Institute of Mathematical Sciences, CIT Campus, Taramani, Chennai 600113, India.
Abstract:
Extensive molecular dynamics computer simulations of an equimolar, glass-forming AB mixture with a large size ratio are presented. While the large A particles show a glass transition around the critical density of mode-coupling theory ρc, the small B particles remain mobile with a relatively weak decrease in their self-diffusion coefficient DB with increasing density. Surprisingly, around ρc, the self-diffusion coefficient of species A, DA, also starts to show a rather weak dependence on density. We show that this is due to finite-size effects that can be understood from the analysis of the collective interdiffusion dynamics.
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