Some important issues

Integral direct TDDFT

Since TDDFT is a capable to study medium to large molecules, so called integral-direct method is preferred in TD-DFT calculation. To apply integral-direct TDDFT, integral-direct SCF should be evoked that fully avoids to store electronic repulsive integrals in disk. Thus, molecules with several tens or even hundred of atoms are possible via TDDFT calcualiton.