colabfit/datasets_for_magnetic_MTP_NatSR2024_training
收藏Hugging Face2025-04-01 更新2025-04-12 收录
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https://hf-mirror.com/datasets/colabfit/datasets_for_magnetic_MTP_NatSR2024_training
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资源简介：
这是一个针对Fe-Al系统的磁性多组分机器学习势函数的训练数据集，包含了0%-50%不同浓度的Fe和Al，以及完全平衡和扰动后的原子位置、晶格向量和磁矩表示。数据集中的额外细节存储在以dataset_为前缀的列中。
This dataset comprises a training dataset for magnetic multi-component machine-learning potentials for Fe-Al systems, including different concentrations of Fe and Al (Al concentrations from 0%-50%), with fully equilibrated and perturbed atomic positions, lattice vectors and magnetic moments represented. Additional details stored in dataset columns prepended with dataset_.
提供机构：
colabfit
