Predicting formation energy from crystal structure
Predict the DFT formation energy of a crystal in eV/atom from its structure, over 132,752 entries.
| # | Route | MAE (eV/atom) ↓ | vs baseline |
|---|---|---|---|
| — | Baseline · Best on the Matbench leaderboard (coGN) | 0.017 | the bars start here |