Lehrstuhl für Theoretische Chemie

On the Function of Saccharides during the Nucleation of Calcium Carbonate--Protein Biocomposites (2013) Duchstein P, Kniep R, Zahn D Journal article Nucleation mechanism and kinetics of the perovskite to post-perovskite transition of MgSiO3 under extreme conditions (2013) Zahn D Journal article Efficient self-consistent treatment of electron correlation within the random phase approximation (2013) Bleiziffer P, Heßelmann A, Görling A Journal article, Original article The role of vibrations in single-molecule charge transport: A case study of oligoynes with pyridine anchor groups (2013) Ballmann SD, Hieringer W, Härtle R, Brana Coto P, Bryce M, Görling A, Thoss M, Weber HB Journal article, Original article On the short-range behavior of correlated pair functions from the adiabatic-connection fluctuation-dissipation theorem of density-functional theory (2013) Heßelmann A, Görling A Journal article, Original article Influence of the exchange-correlation potential in methods based on time-dependent density-functional theory (2013) Bleiziffer P, Heßelmann A, Umrigar CJ, Görling A Journal article, Original article Uranium(III) complexes with bulky aryloxide ligands featuring metal-arene interactions and their reactivity toward nitrous oxide (2013) Franke S, Tran BL, Heinemann FW, Hieringer W, Mindiola DJ, Meyer K Journal article, Original article Supramolecular assembly of multicomponent photoactive systems via cooperatively coupled equilibria (2013) Garcia-Iglesias M, Peuntinger K, Kahnt A, Krausmann J, Vazquez P, Gonzalez-Rodriguez D, Guldi DM, Torres T Journal article, Original article Directional noncovalent interactions: Repulsion and dispersion (2013) Elkerdawy A, Murray JS, Politzer P, Bleiziffer P, Heßelmann A, Görling A, Clark T Journal article, Original article Gold intercalation of boron-doped graphene on Ni(111): XPS and DFT study (2013) Zhao W, Gebhardt J, Gotterbarm K, Höfert O, Gleichweit C, Papp C, Görling A, Steinrück HP Journal article