HfO2_data_and_model

This is the AIMD data and finetuned MACE model for HfO2.

Name		Name	Last commit message	Last commit date
Latest commit History 9 Commits
HfO2_bec_data.xyz		HfO2_bec_data.xyz
HfO2_finetuned_MACE.model		HfO2_finetuned_MACE.model
HfO2_structure_data.xyz		HfO2_structure_data.xyz
LICENSE		LICENSE
P21c_to_Pca21.zip		P21c_to_Pca21.zip
Pca21_to_Pbca.zip		Pca21_to_Pbca.zip
README.md		README.md
hysteresis_loop_traj.xyz		hysteresis_loop_traj.xyz

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