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Interatomic Potential Modeling on Ta-V-Cr-W Deformed Structures (Overall) 1.0

1.91Energy RMSE (meV/atom)GM-NN
-2.069624.792751.65578.5173May 23, 2024

Evaluation results

MethodLinks
GM-NNBatch size=502024.051.917.25—
ICTPsymL=2, Batch size=502024.052.6551.7836.78
MTPBatch size=502024.052.6717.57—
ICTPsymV=2, Batch size=502024.052.8514.9713.15
ICTPsymL=1, Batch size=502024.053.0125.0916.93
ICTPsymL=0, Batch size=502024.053.114.598.48
MACEL=1, Batch size=502024.054.0115.3713.87
MACEL=2, Batch size=502024.054.0329.4828.82
MACEL=0, Batch size=502024.054.294.435.91
EAMBatch size=502024.05101.40.5—