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. 2024 Feb 12;146(7):4783–4794. doi: 10.1021/jacs.3c12843

Figure 10.

Figure 10

Field-dependent oxide-ion mobilities uO obtained from MD simulations of LZO in the range of 2000 ≤ T/K ≤ 2875. Every data point is the average of two independent runs, with their standard deviation included as error bars. Solid lines are predictions calculated with a combination of eqs 46, 14, 28. For the predictions, ΔHaF = (5.32 ± 0.01) eV and ΔSaF = (11.48 ± 0.22) kB from Figure 3 are used; and ΔH‡,r = 18 meV.