Figure 1: X-ray diffraction data for l-ZrO2.
From: Atomic and electronic structures of an extremely fragile liquid
(a) Faber–Ziman total structure factors, S(Q), for l-ZrO2 at 2,600 °C–2,800 °C together with the S(Q) derived from the DF–MD simulation at 2,800 °C. Both the experimental and DF–MD simulation data at 2,800 °C are displaced upward by 1 for clarity. (b) Total correlation functions, T(r), for l-ZrO2 at 2,600–2,800 °C. The sharp peak observed at Q=2.1 Å−1 in the S(Q) of l-ZrO2 can be assigned to the principal peak reported by Salmon et al.21
