遇见数据集

OMat24_validation_rattled_1000_subsampled

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DataCite Commons2025-04-24 更新2025-05-10 收录
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资源简介:

The rattled-1000-subsampled validation split of OMat24 (Open Materials 2024). OMat24 is a large-scale open dataset of density functional theory (DFT) calculations. The dataset is available in subdatasets and subsampled sub-datasets based on the structure generation strategy used. There are two main splits in OMat24: train and validation, each divided into the aforementioned subsampling and sub-datasets.

提供机构:
ColabFit
创建时间:
2025-04-24
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