Core structures of O-decorated basal dislocations in Mg

This data offers the full and extended basal dislocation cores with and without the influence of the interstitial oxygen atoms in the vicinity of dislocation cores. The core structures were calculated by VASP. More details can refer to the paper.本数据集提供了包含及不含邻近位错核心间氧原子影响的完整扩展基本位错核心。核心结构通过VASP软件进行计算。更多详细信息请参阅相关论文。