Supplemental material
Molecular Physics
An International Journal at the Interface Between Chemistry and Physics
Volume 118, 2020 - Issue 19-20: Special Issue of Molecular Physics in Honour of Jürgen Gauss
Research Articles
A case study of density functional theory and domain-based local pair natural orbital coupled cluster for vibrational effects on EPR hyperfine coupling constants: vibrational perturbation theory versus ab initio molecular dynamics
Alexander A. Auera MPI für Kohlenforschung, Mülheim an der Ruhr, GermanyCorrespondence[email protected] [email protected]
https://orcid.org/0000-0001-6012-3027View further author information
https://orcid.org/0000-0001-6012-3027View further author information, , Bikramjit Sharmab Lehrstuhl für Theoretische Chemie, Ruhr-Universität Bochum, Bochum, Germanyhttps://orcid.org/0000-0002-8844-1796View further author information
https://orcid.org/0000-0002-8844-1796View further author information, Georgi L. Stoycheva MPI für Kohlenforschung, Mülheim an der Ruhr, Germanyhttps://orcid.org/0000-0002-3408-5749View further author information
https://orcid.org/0000-0002-3408-5749View further author information, & Frank Neesea MPI für Kohlenforschung, Mülheim an der Ruhr, Germanyhttps://orcid.org/0000-0003-4691-0547View further author information
https://orcid.org/0000-0003-4691-0547View further author information