Lehrstuhl für Theoretische Chemie

On the molecular mechanisms of the acid-induced dissociation of hydroxy-apatite in water (2011) Hochrein O, Zahn D Journal article The surface trans effect: Influence of axial ligands on the surface chemical bonds of adsorbed metalloporphyrins (2011) Hieringer W, Flechtner K, Kretschmann A, Seufert K, Auswärter W, Barth JV, Görling A, et al. Journal article Adsorption and reaction of SO2 on clean and oxygen precovered Pd(100) - A combined HR-XPS and DF study (2011) Luckas N, Gotterbarm K, Streber R, Lorenz MPA, Höfert O, Vines F, Papp C, et al. Journal article Random-phase approximation correlation methods for molecules and solids (2011) Heßelmann A, Görling A Journal article, Review article On the regioselectivity of the insertion step in nickel complex catalyzed dimerization of butene: A density-functional study (2011) Nikiforidis I, Görling A, Hieringer W Journal article, Original article Local exact exchange potentials within the all-electron FLAPW method and a comparison with pseudopotential results (2011) Betzinger M, Friedrich C, Bluegel S, Görling A Journal article, Original article Correct description of the bond dissociation limit without breaking spin symmetry by a random-phase-approximation correlation functional (2011) Heßelmann A, Görling A Journal article, Original article Efficient exact-exchange time-dependent density-functional theory methods and their relation to time-dependent Hartree-Fock (2011) Heßelmann A, Görling A Journal article, Original article Template-assisted formation of fullerenes from short-chain hydrocarbons by supported platinum nanoparticles (2011) Vines Solana F, Görling A Journal article, Original article SO2 adsorption on Pt(111) and oxygen precovered Pt(111): A combined infrared reflection absorption spectroscopy and density functional study (2011) Happel M, Luckas N, Vines Solana F, Sobota M, Laurin M, Görling A, Libuda J Journal article, Original article