The success ratios for optimization in ground state (GS), fluorescence (Fluor), TADF, and AIP computations are 91, 97, 69, and 90% respectively as tabulated in Table . The average computational time per one molecule is about 9 hours for 20 cores. This computation is not definitely light. However, we can build the database for several molecular properties based on the electronic structure theory automatically. Because the multi properties can be simultaneously obtained, the correlation heat map among the computed molecular properties as shown in Fig. is also easily obtained.