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Benchmarks
Atom type generation on MP-20
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90.23
Compositional Accuracy
MCFlow-L
86.9332
87.7891
88.645
89.5009
Feb 23, 2026
Compositional Accuracy
Match Rate
Updated 4d ago
Evaluation Results
Method
Method
Links
Compositional Accuracy
Match Rate
MCFlow-L
Model size=Large, Samp...
2026.02
90.23
15.3
MCFlow-B
Model size=Base, Sampl...
2026.02
90.22
14.73
MCFlow-B
Model size=Base, Sampl...
2026.02
90.17
3.12
MCFlow-L
Model size=Large, Samp...
2026.02
90.07
3.32
MCFlow-S
Model size=Small, Samp...
2026.02
88.97
1.57
MCFlow-S
Model size=Small, Samp...
2026.02
88.71
15.34
CGCNN
Type=Deterministic bas...
2026.02
87.06
4.71
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