Publications

Anita Grupp, Martina Bubrin, Fabian Ehret, Qiang Zeng, Frantisek Hartl, Hana Kvapilova, Stanislav Zalis, and Wolfgang. Kaim. RuII(a-diimine) or RuIII(a-diimineĀ·-)? Structural, Spectroscopic, and Theoretical Evidence for the Stabilization of a Prominent Metal-to-Ligand Charge-Transfer Excited-State Configuration in the Ground State. European Journal of Inorganic Chemistry, (2014)1:110--119, 2014. [PUMA: ESR acetylacetonato alpha charge complex configuration crystal diazabutadiene excited ground ligand metal mol pentanedionate prepn radical ruthenium spectroelectrochem;diimine state structure;stabilization transfer]

Monika Sieger, Matthias Wanner, Wolfgang Kaim, Derk J. Stufkens, Theo L. Snoeck, and Stanislav. Zalis. Low-Valent Cobalt Complexes with Three Different p Acceptor Ligands: Experimental and DFT Studies of the Reduced and the Low-Lying Excited States of (R-DAB)Co(NO)(CO), R-DAB = Substituted 1,4-Diaza-1,4-butadiene. Inorganic Chemistry, (42)10:3340--3346, 2003. [PUMA: DFT;EPR DFT;charge Raman TDDFT;cobalt acceptor azabutadiene cobalt complex excited ligand pi radical state state;IR transfer transition]