Materials Discovery on Matbench Discovery
93.1F1 ScoreEquiformerV3
Evaluation results
| Method | Links | |||||
|---|---|---|---|---|---|---|
| EquiformerV3Prediction=Gradient, Auxiliary Task=DeNS2026.04 | 93.1 | 0.059 | 0.118 | 90.2 | 5.7 | |
| UMA-M-1.1Prediction=Gradient2026.04 | 92.9 | 0.061 | 0.176 | 88.9 | 129 | |
| eSEN-30M-OAMPrediction=Gradient2026.04 | 92.5 | 0.061 | 0.17 | 88.8 | — | |
| PET-OAM-XLPrediction=Gradient2026.04 | 92.4 | 0.06 | 0.119 | 89.8 | 20.5 | |
| EquFlashPrediction=Gradient2026.04 | 91.9 | 0.06 | 0.158 | 88.8 | — | |
| EquiformerV2Prediction=Direct, Configuration=eqV2 M2026.04 | 91.7 | 0.069 | 1.771 | 55.8 | — | |
| NequIP-OAM-XLPrediction=Gradient2026.04 | 90.6 | 0.063 | 0.125 | 88.6 | — | |
| ORB v3Prediction=Gradient2026.04 | 90.5 | 0.075 | 0.21 | 86 | — | |
| ORB v2Prediction=Direct2026.04 | 88 | 0.097 | 1.734 | 52.8 | — | |
| MatterSim v1 5MPrediction=Gradient2026.04 | 86.2 | 0.073 | 0.575 | 76.7 | — | |
| MACE-MPA-0Prediction=Gradient2026.04 | 85.2 | 0.073 | 0.412 | 79.5 | — |