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Benchmarks
Initial Structure to Relaxed Energy on OC20 IS2RE
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0.6024
Energy MAE (eV)
SphereNet
0.599856
0.617028
0.6342
0.651372
Feb 9, 2021
Energy MAE (eV)
EwT
Updated 4d ago
Evaluation Results
Method
Method
Links
Energy MAE (eV)
EwT
SphereNet
Training Dataset=All,...
2021.02
0.6024
3.64
DimeNet++
Training Dataset=All,...
2021.02
0.6217
3.42
GemNet-T
Training Dataset=All,...
2021.02
0.6382
3.38
CGCNN
Training Dataset=All,...
2021.02
0.6585
2.82
SchNet
Training Dataset=All,...
2021.02
0.666
2.65
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