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Apply pyxtal.form_seed() to doped crystals. #297

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cyye001 opened this issue Dec 15, 2024 · 0 comments
Open

Apply pyxtal.form_seed() to doped crystals. #297

cyye001 opened this issue Dec 15, 2024 · 0 comments

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@cyye001
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cyye001 commented Dec 15, 2024

Hello, thank you for providing this useful tool. However, I noticed that pyxtal.form_seed() does not seem to work directly with doped materials, which are quite common in ICSD and can be read by pymatgen using the corresponding CIF files. Do you have any plans to extend the functionality in this area?

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