Hello, I downloaded the database name "dft_3d" and randomly calculated the MBJ band gaps of 100 structures for testing. However, the mean absulute error between the MBJ band gaps calculated by me and that in database was 0.15 eV. I think this may due to different INCAR and KPOINTS settings of VASP calculations, could you provide the INCAR and KPOINTS files when calculating these MBJ band gaps ?
Hello, I downloaded the database name "dft_3d" and randomly calculated the MBJ band gaps of 100 structures for testing. However, the mean absulute error between the MBJ band gaps calculated by me and that in database was 0.15 eV. I think this may due to different INCAR and KPOINTS settings of VASP calculations, could you provide the INCAR and KPOINTS files when calculating these MBJ band gaps ?