colabfit/NNP-Ga2O3
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资源简介：
NNP-Ga2O3数据集包含了9200个β-Ga2O3的配置，包括两组配置集。一组包含在50K到600K温度范围内模拟的8400个配置的DFT数据。另一组包含在0K模拟温度下的配置。
The NNP-Ga2O3 dataset contains 9,200 configurations of beta-Ga2O3, including two configuration sets. One set contains DFT data for 8,400 configurations simulated between temperatures of 50K - 600K. The second set contains configurations with 0K simulation temperature.
提供机构：
colabfit
