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Generate crystal structures with the Matra-Genoa Wyckoff transformer and relax every candidate with ORB v3 via TorchSim: keep the most stable for a formula, or explore a chemical system against Ouro's shared structure database and get its phase diagram. Free (Matra-Genoa is licensed for non-commercial use). Cite: De Breuck et al., npj Comput. Mater. 12, 60 (2026).
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