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Dataset for Revealing Carbon Capture Chemistry with 17-Oxygen NMR Spectroscopy

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https://www.repository.cam.ac.uk/handle/1810/344237
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资源简介:
This .zip file contains: - source data for Figure 2 (.xlxs format). This is a table of the calculated 17-oxygen NMR parameters for a range of different MOF structures. The data is the same as that presented in Table 2. – NMR spectroscopy data (.dx format). Raw solid state NMR spectroscopy data is provided. The raw data is for all of the solid-state NMR work presented in this study. Solution-state NMR spectra of acid-digested MOFs are also provided. – X-ray diffraction data (.csv format). Raw powder X-ray diffraction data for the studied MOFs is provided. – Computationally-derived structure files (.cif and .xyz). Geometry-optimised computational structures are provided for amine-functionalised MOFs (.cif format) and amine-functionalised silicas (.xyz format). See the main manuscript for more details.
提供机构:
Apollo - University of Cambridge Repository
创建时间:
2022-04-28
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