Dataset for "The Impact of Solution Chemistry on Growth and Structural Features of Mo-substituted Spinel Iron Oxides"

This dataset contains the computational data and analysis for the paper "The Impact of Solution Chemistry on Growth and Structural Features of Mo-substituted Spinel Iron Oxides." It includes input and output files for the DFT calculations, performed using VASP, and lightweight analysis scripts used to plot some of the figures in the associated publication.

本数据集包含了论文《溶液化学对钼替代型尖晶石铁氧化物生长及结构特征的影响》的计算数据和分析。其中涵盖了使用VASP进行的DFT计算的输入和输出文件，以及用于绘制相关出版物中部分图表的轻量级分析脚本。