Research data supporting "Multivariate Analysis of Disorder in Metal–Organic Frameworks"

These files include the data published in the paper "Multivariate Analysis of Disorder in Metal–Organic Frameworks", Adam F. Sapnik, et al., Nature Communications, 2022. Figure 3 Powder X-ray diffraction data: Excel data file (.XLSX) (name: PXRD) file 1 Figure 4 X-ray structure factor data: Excel data file (.XLSX) (name: Structure Factors) file 2 Figure 7 X-ray pair distribution functions: Excel data file (.XLSX) of MIL-100 (name: MIL-100 D(r)) file 3 Excel data file (.XLSX) of Fe-BTC (name: Fe-BTC D(r)) file 4 Figure 10 X-ray pair distribution functions: Excel data file (.XLSX) of TIF-4 (name: TIF-4 D(r)) file 5 Figure 11 X-ray structure factor data: Excel data file (.XLSX) of TIF-4 (name: TIF-4 S(Q)) file 6

本数据集包含Adam F. Sapnik等人于2022年发表在《自然-通讯》（Nature Communications）期刊的论文《Multivariate Analysis of Disorder in Metal–Organic Frameworks》（金属有机框架中无序性的多变量分析）中公开的实验数据。具体数据文件详情如下：1. 图3粉末X射线衍射（Powder X-ray diffraction, PXRD）数据：Excel格式（.XLSX）数据文件，命名为"PXRD"，为文件1；2. 图4 X射线结构因子数据：Excel格式（.XLSX）数据文件，命名为"Structure Factors"，为文件2；3. 图7 X射线对分布函数数据：包含两份Excel格式（.XLSX）数据文件，其一为MIL-100的对应数据，命名为"MIL-100 D(r)"，为文件3；其二为Fe-BTC的对应数据，命名为"Fe-BTC D(r)"，为文件4；4. 图10 X射线对分布函数数据：Excel格式（.XLSX）数据文件，对应TIF-4的相关数据，命名为"TIF-4 D(r)"，为文件5；5. 图11 X射线结构因子数据：Excel格式（.XLSX）数据文件，对应TIF-4的相关数据，命名为"TIF-4 S(Q)"，为文件6。