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Benchmarks
Energy and force prediction on Chair-to-boat (out-of-equilibrium)
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0.4
Energy (E)
MoLe-Λ
-2.5852
17.5649
37.715
57.8651
May 28, 2026
Energy (E)
Force (F)
Updated 5d ago
Evaluation Results
Method
Method
Links
Energy (E)
Force (F)
MoLe-Λ
2026.05
0.4
0.13
Mace+MP2
2026.05
0.41
0.83
eSEN+MP2
2026.05
0.68
0.19
eSEN
2026.05
2.89
5.43
Mace
2026.05
3.19
1.87
MP2
2026.05
75.03
0.54
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