I have prepared Lithium ferrite samples doped with Zinc, Titanium, and Manganese. After taking the XRD data I wanted to perform Rietveld refinement. But the problem is that I have cif data available only for Zinc substituted Lithium ferrite. Although I have gone about refinement and it works somewhat, how can I insert the missing substituent in the cif file? Please help.

  • 3
    $\begingroup$ Could you edit the question and add to it relevant part of your existing CIF file? I think only the _atom_site table is relevant. $\endgroup$
    – marcin
    Aug 26, 2023 at 11:28
  • $\begingroup$ Please clarify your specific problem or provide additional details to highlight exactly what you need. As it's currently written, it's hard to tell exactly what you're asking. $\endgroup$
    – Community Bot
    Aug 26, 2023 at 12:12
  • $\begingroup$ My recommendation is to look for another system with similar characteristics and adapt the CIF to your case. $\endgroup$
    – Camps
    Aug 28, 2023 at 21:02


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