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Energy and Force Prediction on rMD17 Benzene
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0.2
Energy MAE (meV)
ACE
0.18
0.315
0.45
0.585
May 9, 2026
Energy MAE (meV)
Force MAE (meV/Å)
Updated 22d ago
Evaluation Results
Method
Method
Links
Energy MAE (meV)
Force MAE (meV/Å)
ACE
Training size=50 molec...
2026.05
0.2
2.7
NequIP
Training size=50 molec...
2026.05
0.6
2.9
PACE
Training size=50 molec...
2026.05
0.6
3.3
MACE
Training size=50 molec...
2026.05
0.6
2.9
MACE
Training size=50 molec...
2026.05
0.7
2.7
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