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Energy and Force Prediction on rMD17 Ethanol (test)
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0.4
Energy
NequIP
0.396
0.423
0.45
0.477
Jun 10, 2023
Energy
Forces
Updated 4d ago
Evaluation Results
Method
Method
Links
Energy
Forces
NequIP
2023.06
0.4
2.8
Allegro
2023.06
0.4
2.1
BOTNet
2023.06
0.4
3.2
MACE
2023.06
0.4
2.1
TensorNet
Layers=1L, Parameters=...
2023.06
0.5
3.9
TensorNet
Layers=2L, Parameters=...
2023.06
0.5
3.5
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