Lehrstuhl für Theoretische Chemie

Role of Specific Intermolecular Interactions for the Arrangement of Ni(II)-5, 10, 15, 20-Tetraphenyltetrabenzoporphyrin on Cu(111) (2015) Lepper M, Zhang L, Stark MW, Ditze S, Lungerich D, Jux N, Hieringer W, et al. Journal article Comparative study of the carbide-modified surfaces C/Mo(110) and C/Mo(100) using high-resolution x-ray photoelectron spectroscopy (2015) Gleichweit C, Neiß C, Maisel S, Bauer U, Späth F, Höfert O, Vollnhals F, et al. Journal article Molecular Orientation and Structural Transformations in Phthalic Anhydride Thin Films on MgO(100)/Ag(100) (2015) Mohr S, Xu T, Döpper T, Laurin M, Görling A, Libuda J Journal article Carbon Nanodots: Supramolecular Electron Donor-Acceptor Hybrids Featuring Perylenediimides (2015) Strauß V, Margraf J, Dirian K, Syrgiannis Z, Prato M, Wessendorf C, Hirsch A, et al. Journal article Infiltration of silver into porous SnO2-x : influence of atmosphere, interfacial reactions, and surface properties (2015) Jung M, Krausmann J, Bender M, Bachmann J, Roedel J Journal article, Original article Self-consistent Kohn-Sham method based on the adiabatic-connection fluctuation-dissipation theorem and the exact-exchange kernel (2015) Görling A, Bleiziffer P, Krug M Journal article Exchange-correlation potentials with proper discontinuities for physically meaningful Kohn-Sham eigenvalues and band structures (2015) Görling A Journal article EMPIRE: a highly parallel semiempirical molecular orbital program: 2: periodic boundary conditions (2015) Margraf J, Hennemann M, Meyer B, Clark T Journal article Cumulene Rotaxanes: Stabilization and Study of [9]Cumulenes (2015) Franz M, Januszewski J, Wendinger D, Neiß C, Movsisyan LD, Hampel F, Anderson HL, et al. Journal article Chiral (SO)-N-(SO) Sulfoxide Pincer Complexes of Mg, Rh, and Ir: N-H Activation and Selective Sulfoxide Reduction upon Ligand Coordination (2015) Locke H, Herrera AC, Heinemann FW, Linden A, Frieß S, Schmid B, Dorta R Journal article