Can TD-DFT calculations accurately describe the excited states behavior of stacked nucleobases? The cytosine dimer as a test case. - Fabrizio Santoro; Vincenzo Barone; Roberto Improta (J. Comput. Chem., 2008)

FCclasses3: Vibrationally-resolved spectra simulated at the edge of the harmonic approximation. - Javier Cerezo; Fabrizio Santoro (J. Comput. Chem., 2023)