De novo crystal generation on MP-20
0.079Energy Hull (eV)MatterGen
Evaluation results
| Method | Links | |||||
|---|---|---|---|---|---|---|
| MatterGenVariant=Base2026.06 | 0.079 | 93.5 | 100 | 86.5 | 5.53 | |
| ALM Gen2026.06 | 0.085 | 98.9 | 100 | 83.2 | 7.8 | |
| ALM GenVariant=FK-stoich2026.06 | 0.086 | 73.8 | 100 | 84.5 | 5.21 | |
| CrysReas2026.06 | 0.45 | 87.23 | 94.92 | 91.78 | 1.7 | |
| CrysReas-ThinkingTraining=SFT+CoT2026.06 | 0.52 | 38.64 | 91.29 | 91.72 | 0.59 | |
| CrysReas-RLTraining=SFT+GRPO2026.06 | 0.53 | 82.49 | 89.85 | 91.1 | 1.23 | |
| PLAID++ Wyckoff2026.06 | 0.57 | 40.7 | 89.06 | 91.59 | 0.5 | |
| CrysReas-BaseTraining=SFT only2026.06 | 0.58 | 35.25 | 84.03 | 90.36 | 0.57 | |
| CrystalTextLLM2026.06 | 0.61 | 47.4 | 90.01 | 91.59 | 0.38 |