遇见数据集

Raw Diffraction Images and (Quantum-)Crystallographic Models of WYLID using MoKa Radiation

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Zenodo2025-01-21 更新2026-05-26 收录
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资源简介:

This dataset contains the raw diffraction images, as well as structural models for a publication in J. Apl. Cryst. using Cu Kb radiation. The raw data can be found in the "images" folder, the structural models in the "struct" folder. The type of model is indicated by the prefix of the model: IAM: Independent Atom Model HAR: Hirshfeld Atom Refinement MM: Multipolar Model XRD: X-ray Restrained Wavefunction Fitting

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Zenodo
创建时间:
2025-01-21
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