Triaging hypothetical crystals for stability
Classify 215,488 hypothetical crystals as stable or not against a fixed DFT convex hull, scored by F1.
| # | 路线 | F1 (stable class, unique prototypes) ↑ | 对比基线 |
|---|---|---|---|
| — | 基线 · Matbench Discovery leader (EquiformerV3+DeNS-OAM) | 0.931 | 条形从这里开始 |