Model for optb88vdw_total_energy
Model benchmarks
| Model name | Dataset |
MAE |
Team name |
Dataset size |
Date submitted |
Notes |
| cfid_chem | dft_3d | 0.3526 | JARVIS | 55713 | 01-14-2023 | CSV, JSON, run.sh, Info |
| matminer_rf | dft_3d | 0.1544 | UofT | 55713 | 05-22-2023 | CSV, JSON, run.sh, Info |
| matminer_lgbm | dft_3d | 0.1509 | Matminer | 55713 | 01-14-2023 | CSV, JSON, run.sh, Info |
| kgcnn_cgcnn | dft_3d | 0.1374 | kgcnn | 55713 | 01-14-2023 | CSV, JSON, run.sh, Info |
| cgcnn_model | dft_3d | 0.0815 | CGCNN | 55713 | 01-14-2023 | CSV, JSON, run.sh, Info |
| kgcnn_schnet | dft_3d | 0.0625 | kgcnn | 55713 | 01-14-2023 | CSV, JSON, run.sh, Info |
| kgcnn_megnet | dft_3d | 0.0393 | kgcnn | 55713 | 05-06-2023 | CSV, JSON, run.sh, Info |
| matminer_xgboost | dft_3d | 0.0936 | UofT | 55713 | 05-22-2023 | CSV, JSON, run.sh, Info |
| cfid | dft_3d | 0.2436 | JARVIS | 55713 | 01-14-2023 | CSV, JSON, run.sh, Info |
| kgcnn_coNGN | dft_3d | 0.0273 | kgcnn | 55713 | 05-06-2023 | CSV, JSON, run.sh, Info |
| alignn_model | dft_3d | 0.0367 | ALIGNN | 55713 | 01-14-2023 | CSV, JSON, run.sh, Info |
| kgcnn_coGN | dft_3d | 0.0262 | kgcnn | 55713 | 05-06-2023 | CSV, JSON, run.sh, Info |
| potnet | dft_3d | 0.0321 | DIVE@TAMU | 55713 | 06-02-2023 | CSV, JSON, run.sh, Info |
| kgcnn_dimenetPP | dft_3d | 0.051 | kgcnn | 55713 | 05-06-2023 | CSV, JSON, run.sh, Info |
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