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. 2022 May 11;78(Pt 3):385–391. doi: 10.1107/S2052520622003560

Figure 4.

Figure 4

Compositional variation of the diffuse scattering width, determined using Lorentzian fits to the W–Δ–W scattering profiles calculated from our Monte Carlo configurations (short-range order parameter α = 0.7, red symbols) compared with the experimental data given in Fig. 1(f) (black symbols). The curves are error-weighted empirical fits of the form f(x) = (ax + b) + c[x(1 − x)], where the linear term represents a virtual-crystal (mean-field) contribution, and the binomial term captures the deviation that results from inhomogeneous mixing. The key result is that both experiment and calculation indicate broadened diffuse scattering features at intermediate compositions.