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Rapid Structure Determination Of Microcrystalline Molecular Compounds Using Electron Diffraction (Nanoargovia Project A3Edpi)

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Zenodo2020-09-20 更新2026-05-25 收录
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The are the data linked to the publication "Rapid structure determination of microcrystalline molecular compounds using electron diffraction", 10.1002/anie.201811318. Electron Diffraction data collected with an EIGER X 1M detector (DECTRIS Ltd.). Each tar file contains the raw files in HDF5 format, together with the XDS.INP file used for data integration. Images of the respective crystals have '_img_' in their file names. The log files for recording the stage alpha angle are included with the same name and suffix .txt. See publication for details. NB: The meta-data in the HDF5 files have no meaning, please refer to the respective XDS.INP file for respective information. The crystallographic data (CIF-files) have been uploaded to the ICSD (High--throughput Structural Chemistry with Electron Diffraction) and CSD (https://www.ccdc.cam.ac.uk/) respectively: Paracetamol from Grippostad CCDC 1856579<br> electron structure of MBBF4 CCDC 1856580 ZSM-5 x227 CSD 1856581 ZSM-5 x331 CSD 1856582 ZSM-5 x79 CSD 1856583<br> ZSM-5 x811 CSD 1856584

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创建时间:
2018-10-17
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