colabfit/PWMLFF_feature_comparison_NPJ2023
收藏Hugging Face2025-04-01 更新2025-04-12 收录
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https://hf-mirror.com/datasets/colabfit/PWMLFF_feature_comparison_NPJ2023
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资源简介：
这是一个用于评估不同机器学习力场特征准确性的部分数据集，包含余弦特征、高斯特征等多种特征类型，并应用于无定形硫系统和碳系统。数据集通过比较不同特征类型的均方根误差来评估其描述物理系统的能力。
A partial dataset for evaluating the accuracy of different machine learning force field features, including various feature types such as cosine feature, Gaussian feature, and applied to amorphous sulfur systems and carbon systems. The dataset assesses the ability of different feature types to describe physical systems by comparing the root mean square error.
提供机构：
colabfit
