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Name HfO2-DPGEN-PRB-2021
Extended ID HfO2-DPGEN-PRB-2021_WuZhangZhangLiu__DS_klj8wt21p021_0
Description Approximately 28,500 configurations of hafnia (HfO2) used in the training of a DP model for the prediction of properties of various hafnia polymorphs, including transition barriers between different phases.
Authors Jing Wu
Yuzhi Zhang
Linfeng Zhang
Shi Liu
Elements Hf (33.33%)
O (66.67%)
Number of Data Objects 28,508
Number of Configurations 28,508
Number of Atoms 2,736,768
Configuration Sets by Name (None)
Configuration Sets by ID (None)
Data Objects Too many to display
ColabFit ID DS_klj8wt21p021_0
Files colabfitspec.json

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