Prof. Dr. Dirk Zahn

Professur für Theoretische Chemie

Molecular Characterization of Mesoporous Silica (Un)loading by Gemcitabine and Ibuprofen – An Interplay of Salt-Bridges and Hydrogen Bonds (2024) Aziz A, Macht M, Becit B, Zahn D Journal article Bottom-to-top modeling of epoxy resins: From atomic models to mesoscale fracture mechanisms (2024) Konrad J, Zahn D Journal article Organic Nucleation: Water Rearrangement Reveals the Pathway of Ibuprofen (2024) Lu H, Macht M, Rosenberg R, Wiedenbeck E, Lukas M, Qi D, Maltseva D, et al. Journal article Self‐Assembled Supported Ionic Liquids (2023) Tavera Méndez CL, Bergen A, Trzeciak S, Heinemann FW, Graf R, Zahn D, Meyer K, et al. Journal article Interfaces in reinforced epoxy resins: from molecular scale understanding towards mechanical properties (2023) Konrad J, Zahn D Journal article Tailoring the Selectivity of 1,3-Butadiene versus 1-Butene Adsorption on Pt(111) by Ultrathin Ionic Liquid Films (2023) Winter L, Trzeciak S, Fernandez CC, Massicot S, Talwar T, Maier F, Zahn D, Steinrück HP Journal article Structure Formation in an Ionic Liquid Wetting Layer: A Combined STM, IRAS, DFT and MD Study of [C2C1Im][OTf] on Au(111) (2023) Bühlmeyer H, Hauner J, Eschenbacher R, Steffen J, Trzeciak S, Taccardi N, Görling A, et al. Journal article Thermal Stability and CO Permeability of [C4C1Pyr][NTf2]/Pd(111) Model SCILLs: from UHV to Ambient Pressure (2023) Eschenbacher R, Trzeciak S, Schuschke C, Schötz S, Hohner C, Blaumeiser D, Zahn D, et al. Journal article Efficient Assessment of ‘Instantaneous pK’ Values from Molecular Dynamics Simulations (2023) Duchstein P, Löffler F, Zahn D Journal article Molecular Simulations and Network Analyses of Surface/Interface Effects in Epoxy Resins: How Bonding Adapts to Boundary Conditions (2022) Konrad J, Moretti P, Zahn D Journal article