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Benchmarks
Interatomic Potential Prediction on Na8/9Cl8+ (test)
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0.455
Energy RMSE (meV/atom)
SO3KRATES
-0.838
7.88975
16.6175
25.34525
May 28, 2022
Energy RMSE (meV/atom)
Forces RMSE (meV/Å)
Charges RMSE
Updated 4d ago
Evaluation Results
Method
Method
Links
Energy RMSE (meV/atom)
Forces RMSE (meV/Å)
Charges RMSE
SO3KRATES
non-local=false, F=132...
2022.05
0.455
3.126
-
SO3KRATES
non-local=true, F=132,...
2022.05
0.474
3.316
-
SPOOKYNET
2022.05
1.052
1.052
0.111
2G-BPNN
2022.05
1.692
57.39
20.8
3G-BPNN
2022.05
2.042
76.67
1.323
4G-BPNN
2022.05
32.78
15.82
-
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