Formation Energy On Salicylic Acid

MAE

评测结果

各个模型在此基准测试上的表现结果

模型名称	MAE	Paper Title	Repository
NequIP	6.29	EGraFFBench: Evaluation of Equivariant Graph Neural Network Force Fields for Atomistic Simulations	-
MACE	165.29	EGraFFBench: Evaluation of Equivariant Graph Neural Network Force Fields for Atomistic Simulations	-
BOTNet	153.06	EGraFFBench: Evaluation of Equivariant Graph Neural Network Force Fields for Atomistic Simulations	-
Allegro	8.59	EGraFFBench: Evaluation of Equivariant Graph Neural Network Force Fields for Atomistic Simulations	-

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