Reads G16 restricted TDDFT rwf and log files and computes oscillator strengths and excitation energies with SOC included perturbatively.
Please cite https://doi.org/10.1021/jacsau.2c00659
Reads G16 restricted TDDFT rwf and log files and computes oscillator strengths and excitation energies with SOC included perturbatively.
Please cite https://doi.org/10.1021/jacsau.2c00659