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Generate a crystal structure using GGen
Exploring the intersection of AI and materials science: crystal generation, property prediction, and open models.
Findings from screening C14 MgZn₂-type Laves phases in Mn-Fe-Si: GPSK-05 generation failures, Orb v3 relaxation artifacts, ALIGNN stability results, and a reusable validation framework.
Mapping the crystal generation → ML screening → DFT MAE workflow for rare-earth-free permanent magnet discovery