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Benchmarks
Structure to Energy and Forces on OC20 S2EF (test)
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219
Energy MAE (meV)
EquiformerV2
206.16
292.83
379.5
466.17
Jun 21, 2023
Energy MAE (meV)
Force MAE (meV/Å)
Updated 4d ago
Evaluation Results
Method
Method
Links
Energy MAE (meV)
Force MAE (meV/Å)
EquiformerV2
Training set=OC20 S2EF...
2023.06
219
14.2
EquiformerV2
Training set=OC20 S2EF...
2023.06
227
13.8
eSCN L=6 K=20
Training set=OC20 S2EF...
2023.06
228
15.6
EquiformerV2
Training set=OC20 S2EF...
2023.06
228
15.5
EquiformerV2
Training set=OC20 S2EF...
2023.06
229
14.8
GemNet-OC-L-E
Training set=OC20 S2EF...
2023.06
230
21
GemNet-OC
Training set=OC20 S2EF...
2023.06
233
20.7
GemNet-OC-L-F
Training set=OC20 S2EF...
2023.06
241
19
GemNet-dT
Training set=OC20 S2EF...
2023.06
292
24.2
SpinConv
Training set=OC20 S2EF...
2023.06
336
29.7
DimeNet++-L-F+E
Training set=OC20 S2EF...
2023.06
480
31.3
SchNet
Training set=OC20 S2EF...
2023.06
540
54.7
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