Data from Fig. 2 of “Benchmarking of machine learning interatomic potentials for reactive hydrogen dynamics at metal surfaces”
收藏Figshare2024-04-30 更新2026-04-08 收录
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https://figshare.com/articles/dataset/Data_from_Fig_2_of_Benchmarking_of_machine_learning_interatomic_potentials_for_reactive_hydrogen_dynamics_at_metal_surfaces_/25723713/1
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资源简介：
The test energy, force, and hydrogen force RMSEs and MAEs obtained with different settings of 4 machine learning interatomic potentials (ACE, MACE, PaiNN, and REANN) with the corresponding evaluation speeds, based on Fig. 2 of "Benchmarking of machine learning interatomic potentials for reactive hydrogen dynamics at metal surfaces" by Wojciech G. Stark, Cas van der Oord, Ilyes Batatia, Yaolong Zhang, Bin Jiang, Gabor Csanyi, and Reinhard J. Maurer.<br><br>
提供机构：
Stark, Wojciech
创建时间：
2024-04-30
