SEDRUO (As-Me) eq NBO7 => Def2-QZVPP LP ( 2) S 4 101. BD*( 2)Ti 1- S 2 21.58 Zenodo (CERN European Organization for Nuclear Research) 2026 Dataset Open access Read full text Cite Bookmark Add to export Share Authors: Henry S. Rzepa DOI: 10.5281/zenodo.22669613 Cited by: 2 Publication details Journal / source Zenodo (CERN European Organization for Nuclear Research) Publication date 9 September 2026 Document type Dataset Reference Details Loading... Open full details