https://doi.org/10.1140/epje/s10189-021-00060-7
Regular Article - Soft Matter
Dynamic heterogeneity, cooperative motion, and Johari–Goldstein
-relaxation in a metallic glass-forming material exhibiting a fragile-to-strong transition
1
Department of Chemical and Materials Engineering, University of Alberta, T6G 1H9, Edmonton, Alberta, Canada
2
Wuhan National High Magnetic Field Center, Huazhong University of Science and Technology, 430074, Wuhan, Hubei, China
3
Material Measurement Laboratory, Materials Science and Engineering Division, National Institute of Standards and Technology(NIST), 20899, Gaithersburg, MD, USA
a
hao.zhang@ualberta.ca
d
jack.douglas@nist.gov
Received:
26
January
2021
Accepted:
21
March
2021
Published online:
19
April
2021
We investigate the Johari–Goldstein (JG) -relaxation process in a model metallic glass-forming (GF) material (
), previously studied extensively by both frequency-dependent mechanical measurements and simulation studies devoted to equilibrium properties, by molecular dynamics simulations based on validated and optimized interatomic potentials with the primary aim of better understanding the nature of this universal relaxation process from a dynamic heterogeneity (DH) perspective. The present relatively low temperature and long-time simulations reveal a direct correspondence between the JG
-relaxation time
and the lifetime of the mobile particle clusters
, defined as in previous DH studies, a relationship dual to the corresponding previously observed relationship between the
-relaxation time
and the lifetime of immobile particle clusters
. Moreover, we find that the average diffusion coefficient D nearly coincides with
of the smaller atomic species (Al) and that the ‘hopping time’ associated with D coincides with
to within numerical uncertainty, both trends being in accord with experimental studies. This indicates that the JG
-relaxation is dominated by the smaller atomic species and the observation of a direct relation between this relaxation process and rate of molecular diffusion in GF materials at low temperatures where the JG
-relaxation becomes the prevalent mode of structural relaxation. As an unanticipated aspect of our study, we find that
exhibits fragile-to-strong (FS) glass formation, as found in many other metallic GF liquids, but this fact does not greatly alter the geometrical nature of DH in this material and the relation of DH to dynamical properties. On the other hand, the temperature dependence of the DH and dynamical properties, such as the structural relaxation time, can be significantly altered from ‘ordinary’ GF liquids.
Supplementary Information The online version supplementary material available at https://doi.org/10.1140/epje/s10189-021-00060-7.
© The Author(s), under exclusive licence to EDP Sciences, SIF and Springer-Verlag GmbH Germany, part of Springer Nature 2021