Relaxed Adsorption-Energy Prediction on OC20 340k (test)
0.424MAE (eV)QE-Catalytic-v2
Evaluation results
| Method | Links | ||
|---|---|---|---|
| QE-Catalytic-v2Training Data=OC20 (340k)2026.05 | 0.424 | 81.3 | |
| QE-CatalyticTraining Data=OC20 (340k)2026.05 | 0.486 | 74.2 | |
| UMATraining Data=OC20 (340k)2026.05 | 0.647 | 69.7 | |
| EquiformerV2Training Data=OC20 (340k)2026.05 | 0.682 | 65.1 | |
| E2GNNTraining Data=OC20 (340k)2026.05 | 0.691 | 64.4 | |
| DimeNet++Training Data=OC20 (340k)2026.05 | 0.713 | 58.4 | |
| EquiformerTraining Data=OC20 (340k)2026.05 | 0.814 | 43.9 | |
| GemNet-OCTraining Data=OC20 (340k)2026.05 | 0.841 | 42.8 | |
| PaiNNTraining Data=OC20 (340k)2026.05 | 0.926 | 33.8 | |
| SchNetTraining Data=OC20 (340k)2026.05 | 0.988 | 32.4 |