Lehrstuhl für Theoretische Chemie

On-Surface Synthesis and Characterization of Honeycombene Oligophenylene Macrocycles (2017) Chen M, Shang J, Wang Y, Wu K, Kuttner J, Hilt G, Hieringer W, Gottfried JM Journal article On-surface synthesis of heptacene and its interaction with a metal surface (2017) Zugermeier M, Gruber M, Schmid M, Klein BP, Ruppenthal L, Mueller P, Einholz R, et al. Journal article Accurate Intermolecular Potential for the C-60 Dimer: The Performance of Different Levels of Quantum Theory (2017) Sharapa D, Margraf JT, Heßelmann A, Clark T Journal article Molecular Dynamics Simulation of Phosphonic Acid–Aluminum Oxide self-organization and their evolution into ordered monolayers (2017) Dietrich H, Schmaltz T, Halik M, Zahn D Journal article, Report Catalytically Triggered Energy Release from Strained Organic Molecules: The Surface Chemistry of Quadricyclane and Norbornadiene on Pt(111) (2017) Bauer U, Mohr S, Döpper T, Bachmann P, Späth F, Düll F, Schwarz M, et al. Journal article, Original article ZnO Nanoparticle Formation from the Molecular Precursor [MeZnOtBu]4 by Ozone Treatment in Ionic Liquids: in-situ Vibrational Spectroscopy in an Ultrahigh Vacuum Environment (2017) Bauer T, Voggenreiter M, Xu T, Wähler T, Agel F, Pohako-Esko K, Schulz P, et al. Journal article, Original article Understanding band gaps of solids in generalized Kohn-Sham theory (2017) Perdew JP, Yang W, Burke K, Yang Z, Gross EKU, Scheffler M, Scuseria GE, et al. Journal article, Original article Triethynylmethanol Derivatives: Stable Acetylenic Building Blocks for Surface Chemistry (2017) Prenzel D, Sander T, Gebhardt J, Soni H, Hampel F, Görling A, Maier S, Tykwinski R Journal article, Original article Selective reduction of SWCNTs-concepts and insights (2017) Gebhardt J, Bosch S, Hof F, Hauke F, Hirsch A, Görling A Journal article, Original article Exploring the Formation of Black Phosphorus Intercalation Compounds with Alkali Metals (2017) Abellan Saez G, Neiß C, Lloret Segura VJ, Wild S, Chacón-Torres JC, Werbach K, Fedi F, et al. Journal article, Original article