Loïc Barnes, Baptiste Schindler, Isabelle Compagnon, Abdul-Rahman Allouche. Fast and accurate hybrid QM//MM approach for computing anharmonic corrections to vibrational frequencies.
Journal of Molecular Modeling, Springer Verlag (Germany), 2016, 22 (11),
⟨10.1007/s00894-016-3135-5⟩.
⟨hal-01673969⟩