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. 2023 Apr 6;14(18):4806–4816. doi: 10.1039/d3sc00426k

Fig. 4. Fits to the (a) MnWO4 and (b) FeWO4 product phases, using wolframite-MWO4 structures from the ICSD (code 67 906 (ref. 42) and 26 843,43 respectively). Details of the fits are found in tables of Fig. S6 in the ESI. (c) Results from reverse sequential real space Rietveld refinements of MnWO4 and FeWO4 structures to the PDFs in the range of 1.3–60 Å. Scale factor, crystallite size (cr. size) in nm and isotropic ADPs (uiso in Å2) for W and Mn/Fe are shown in addition to ΔWy, which is the atomic position deviation of W from the octahedral center (defined as 0.13), along the y-axis. The time range where the FeWO4 intermediate phase is present is highlighted with a grey colour.

Fig. 4