Data underlying the publication: High Stability of Methanol to Aromatic Conversion over Bimetallic Ca,Ga-Modified ZSM-5

There are two folders: Experimental_data and Theoretical_data. The Experimental_data contains the experimental results on metal contents determined by ICP analysis; XRD patterns; unit-cell lattice parameters and crystallinity results of all catalysts; FTIR spectra; MeOH conversion and carbon yields of BTEX and MTA. The Theoretical_data folder contains the results on the genetic algorithm, structures optimization and reaction mechanisms of ethane dehydrogenation. The structure of the theoretical data is described in the README file.

本数据集包含两个子文件夹，分别为实验数据（Experimental_data）与理论数据（Theoretical_data）。其中实验数据文件夹收录了所有催化剂经电感耦合等离子体（ICP, Inductively Coupled Plasma）分析得到的金属含量测定结果、X射线衍射（XRD, X-ray Diffraction）谱图、晶胞晶格参数与结晶度结果、傅里叶变换红外（FTIR, Fourier Transform Infrared）光谱，以及苯、甲苯、乙苯和二甲苯（BTEX, Benzene, Toluene, Ethylbenzene, Xylenes）与甲醇制芳烃（MTA, Methanol to Aromatics）反应的甲醇转化率及碳收率数据。理论数据文件夹则涵盖乙烷脱氢反应的遗传算法、结构优化及反应机理相关研究结果，其具体组织结构详见README文件。