Computer-Chemie-Centrum (CCC)

Interpreting the variations in the kinetic and potential energies in the formation of a covalent bond (2022) Clark T, Politzer P, Murray JS Journal article Altering singlet fission pathways in perylene-dimers; perylene-diimide versus perylene-monoimide (2022) Papadopoulos I, Gutierrez-Moreno D, Bo Y, Casillas R, Greißel P, Clark T, Fernandez-Lazaro F, Guldi DM Journal article Oxidation Enhances Binding of Extrahelical 5-Methyl-Cytosines by Thymine DNA Glycosylase (2022) Beierlein F, Volkenandt S, Imhof P Journal article Two Rings Around One Ball: Stability and Charge Localization of [1 : 1] and [2 : 1] Complex Ions of [10]CPP and C60/70[*] (2022) Freiberger M, Minameyer M, Solymosi I, Frühwald S, Krug M, Xu Y, Hirsch A, et al. Journal article Oriented Thiophene-Extended Benzotrithiophene Covalent Organic Framework Thin Films: Directional Electrical Conductivity (2022) Frey L, Poehls JF, Hennemann M, Maehringer A, Reuter S, Clark T, Weitz RT, Medina DD Journal article Directed Dehydration as Synthetic Tool for Generation of a New Na4SnS4 Polymorph: Crystal Structure, Na+ Conductivity, and Influence of Sb-Substitution (2022) Hartmann F, Benkada A, Indris S, Poschmann M, Luehmann H, Duchstein P, Zahn D, Bensch W Journal article Resolution of Intramolecular Dipoles and a Push-Back Effect of Individual Molecules on a Metal Surface (2022) Trishin S, Müller T, Rolf D, Lotze C, Rietsch P, Eigler S, Meyer B, Franke KJ Journal article Solar Energy Storage: Competition between Delocalized Charge Transfer and Localized Excited States in the Norbornadiene to Quadricyclane Photoisomerization (2021) Alex W, Lorenz P, Henkel C, Clark T, Hirsch A, Guldi DM Journal article Interaction of thymine dna glycosylase with oxidised 5-methyl-cytosines in their amino-and imino-forms (2021) Volkenandt S, Beierlein F, Imhof P Journal article General relation between stacking order and Chern index: A topological map of minimally twisted bilayer graphene (2021) Theil S, Fleischmann M, Gupta R, Rost F, Wullschläger F, Sharma S, Meyer B, Shallcross S Journal article