Adsorption-energy prediction on OC20 (460k)
-9.82Improvement MAE (%) vs CatBERTaGAP-CatBERTa
Evaluation results
| Method | Links | ||||
|---|---|---|---|---|---|
| GAP-CatBERTaPretrain Data=OC20 (460k), Fine-tuning Data=OC20 (460k), Inference Input=text-only2025.12 | -9.82 | — | — | 18.32 | |
| QE-Catalytic*Pretrain Data=OC20 (460k), Fine-tuning Data=OC20 (460k), Inference Input=text-only2025.12 | -18.1 | — | — | 24 | |
| QE-CatalyticPretrain Data=OC20 (460k), Fine-tuning Data=OC20 (460k), Inference Input=3D+text2025.12 | -31.8 | — | — | 35 |