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Ground-state energy calculation on 4th row atoms
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-1,263.65
Ground-state energy (Ha)
DeepErwin
-1,290.204612
-1,110.960981
-931.71735
-752.473719
May 19, 2022
Ground-state energy (Ha)
Updated 4d ago
Evaluation Results
Method
Method
Links
Ground-state energy (Ha)
DeepErwin
System=Fe, Epochs=100k
2022.05
-1,263.65
DeepErwin
System=Fe, Epochs=50k
2022.05
-1,263.633
MRCI-F12(Q)
System=Fe
2022.05
-1,263.4947
MRCI-F12
System=Fe
2022.05
-1,263.4281
DeepErwin
System=K, Epochs=100k
2022.05
-599.9195
DeepErwin
System=K, Epochs=50k
2022.05
-599.9178
MRCI-F12(Q)
System=K
2022.05
-599.8238
MRCI-F12
System=K
2022.05
-599.7847
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