Computer-Chemie-Centrum

Nitrogen Oxide Atom-Transfer Redox Chemistry; Mechanism of NO(g) to Nitrite Conversion Utilizing μ-oxo Heme-Fe ^III-O-Cu ^II(L) Constructs (2015) Hematian S, Kenkel I, Shubina T, Dürr M, Liu JJ, Siegler MA, Ivanovic-Burmazovic I, Karlin KD Journal article, Original article Tuning the reorganization energy of electron transfer in supramolecular ensembles - metalloporphyrin, oligophenylenevinylenes, and fullerene - and the impact on electron transfer kinetics (2015) Stangel C, Schubert C, Kuhri S, Rotas G, Margraf J, Regulska E, Clark T, et al. Journal article Thermochromic and solvatochromic properties of Lindqvist polyoxometalates (2015) Herrmann S, Margraf J, Clark T, Streb C Journal article sigma-Hole Bonding: A Physical Interpretation (2015) Politzer P, Murray JS, Clark T Authored book On-off switch of charge-separated states of pyridine-vinylene-linked porphyrin-C-60 conjugates detected by EPR (2015) Kirner S, Arteaga D, Henkel C, Margrat JT, Alegret N, Ohkubo K, Insuasty B, et al. Journal article Atomistic modeling of a KRT35/KRT85 keratin dimer: folding in aqueous solution and unfolding under tensile load (2015) Duchstein P, Clark T, Zahn D Journal article A push-pull unsymmetrical subphthalocyanine dimer (2015) Zango G, Zirzlmeier J, Claessens CG, Clark T, Victoria Martinez-Diaz M, Guldi DM, Torres T Journal article A carbon-carbon hybrid - immobilizing carbon nanodots onto carbon nanotubes (2015) Strauß V, Margraf J, Clark T, Guldi DM Journal article Multiply Bonded Metal(II) Acetate (Rhodium, Ruthenium, and Molybdenum) Complexes with the trans-1,2-Bis(N-methylimidazol-2-yl)ethylene Ligand (2014) Fritsch N, Wick C, Waidmann T, Dral P, Tucher J, Heinemann FW, Shubina T, et al. Journal article A Molecular Placeholder Strategy To Access a Family of Transition-Metal-Functionalized Vanadium Oxide Clusters (2014) Kastner K, Margraf J, Clark T, Streb C Journal article