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Triaging hypothetical crystals for stability
Classify 215,488 hypothetical crystals as stable or not against a fixed DFT convex hull, scored by F1.
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The baseline stands at 0.931 F1 (stable class, unique prototypes).
Classify 215,488 hypothetical crystals as stable or not against a fixed DFT convex hull, scored by F1.
The baseline stands at 0.931 F1 (stable class, unique prototypes).