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Benchmarks
Crystal Structure Generation on MP-20
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77.85
Match Rate
DiffCSP
13.0996
29.9098
46.72
63.5302
Jul 30, 2023
Match Rate
RMSE
Updated 3d ago
Evaluation Results
Method
Method
Links
Match Rate
RMSE
DiffCSP
# of samples=20
2023.07
77.85
0.0493
CDVAE
# of samples=20
2023.07
67.2
0.1012
DiffCSP
# of samples=1
2023.07
51.89
0.0611
CDVAE
# of samples=1
2023.07
33.93
0.1069
P-cG-SchNet
# of samples=20
2023.07
32.7
0.302
P-cG-SchNet
# of samples=1
2023.07
15.59
0.3747
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