Fast and accurate hybrid QM//MM approach for computing anharmonic corrections to vibrational frequencies
Crossref DOI link: https://doi.org/10.1007/s00894-016-3135-5
Published Online: 2016-11-02
Published Print: 2016-11
Update policy: https://doi.org/10.1007/springer_crossmark_policy
Barnes, Loïc
Schindler, Baptiste
Compagnon, Isabelle
Allouche, Abdul-Rahman
License valid from 2016-11-01