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Benchmarks
Material Property Prediction on Materials Project (test)
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0.197
Total Energy MAE (eV/atom)
CFT
0.18676
0.25588
0.325
0.39412
Dec 16, 2025
Total Energy MAE (eV/atom)
Band Gap MAE (eV)
Bulk Moduli MAE (log GPa)
Shear Moduli MAE (log GPa)
Updated 5d ago
Evaluation Results
Method
Method
Links
Total Energy MAE (eV/atom)
Band Gap MAE (eV)
Bulk Moduli MAE (log GPa)
Shear Moduli MAE (log GPa)
CFT
Encoding=Symmetry-adap...
2025.12
0.197
0.306
0.082
0.158
ALIGNN
2025.12
0.203
0.235
0.076
0.16
Transformer
Encoding=Standard posi...
2025.12
0.22
0.44
0.142
0.226
Matformer
2025.12
0.371
0.213
0.074
0.179
CGCNN
2025.12
0.453
0.343
0.093
0.178
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