遇见数据集

Supplementary information on thionasilite

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Zenodo2025-12-11 更新2026-05-26 收录
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This record contains supplementary data for the study of the mineral thionasilite.It includes: Crystal structure data from single-crystal X-ray diffraction (CIF file and checkCIF report). Input and output files from ab initio calculations performed with CP2K. Input files and scripts for thermodynamic modeling using GEMS and XGEMS.

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Zenodo
创建时间:
2025-12-11
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