.xyz files of optimised helicene dimer structures

.xyz files obtained from optimisation at the at the DFT-D3(BJ)-TPSS-D3/def2-TZVP level.本数据集收录了在DFT-D3(BJ)-TPSS-D3/def2-TZVP理论水平下经结构优化得到的.xyz格式文件。