SIMPRE: A software package to calculate crystal field parameters, energy levels, and magnetic properties on mononuclear lanthanoid complexes based on charge distributions. - José J. Baldoví; Salvador Cardona-Serra; Juan M. Clemente-Juan; Eugenio Coronado; Alejandro Gaita-Ariño; Andrew V. Palii (J. Comput. Chem., 2013)

An updated version of the computational package SIMPRE that uses the standard conventions for Stevens crystal field parameters. - José J. Baldoví; Juan M. Clemente-Juan; Eugenio Coronado; Alejandro Gaita-Ariño; Andrew V. Palii (J. Comput. Chem., 2014)

SIMPRE1.2: Considering the hyperfine and quadrupolar couplings and the nuclear spin bath decoherence. - Salvador Cardona-Serra; Luis Escalera-Moreno; José J. Baldoví; Alejandro Gaita-Ariño; Juan M. Clemente-Juan; Eugenio Coronado (J. Comput. Chem., 2016)