Figure 1: Dynamic and relaxation anomalies in Ge–Se glass-forming melts. | Nature Communications

Figure 1: Dynamic and relaxation anomalies in Ge–Se glass-forming melts.

From: Revealing the role of molecular rigidity on the fragility evolution of glass-forming liquids

Figure 1

At low Ge content, the structure of Ge–Se liquids is made of a Se chains with few GeSe4/2 tetrahedral crosslinks (MD snapshots of Ge10Se90), (a) whereas the structure of the stoichiometric GeSe2 (b) is made of a network of connected tetrahedra. (c) Calculated Ge and Se diffusion constants D at 1,050 K as a function of Ge content. The inset shows the calculated jump probability that a Ge/Se atom has jumped by a distance r>2.88 Å during t=20 ps. (d) Calculated Stokes–Einstein liquid viscosities η and Kohlrausch fitted relaxation time τα of the calculated intermediate scattering function Fs(k,t) (right axis) at 1,050 K as a function of Ge content. The open symbols (τα) refer to the particular value Fs(k,τα)=1/e. Error bars are in most of the cases of the size of the symbols but some are visible.

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