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Energy barrier prediction on PdAg surfaces

0.07MAENequIP RECIO
0.06680.08840.110.1316Sep 18, 2025

Evaluation results

MethodLinks
NequIP RECIOTraining Protocol=from-scratch2025.090.07—
TACE LESTraining Protocol=from-scratch, Batch size=16, Epoch=2162025.090.07—
NequIP OAM-LTraining Protocol=uMLIPs2025.090.1—
OrbV3 con-infTraining Protocol=uMLIPs2025.090.11—
MACE OMAT-mediumTraining Protocol=uMLIPs2025.090.11—
MACE OMAT-mediumTraining Protocol=finetune2025.090.11—
Allegro OAM-LTraining Protocol=uMLIPs2025.090.15—