Prof. Dr. Dirk Zahn

Professur für Theoretische Chemie

Experimental and computational study of ecofriendly synthesis of silver nanoparticles from natural extracts: Self-controlled nucleation and growth, and colorimetric detection of heavy metal ions (2025) Wonglakhon T, Jommala N, Laksee S, Nuengmatcha P, Ninwong B, Zahn D, Thepchuay Y Journal article MRGPRX2 ligandome: Molecular simulations reveal three categories of ligand-receptor interactions (2025) Maier P, Macht M, Beck S, Kolkhir P, Babina M, Kremer A, Zahn D, Wolf K Journal article Tailorable Nanoparticles for Magnetic Water Cleaning of Polychlorinated Biphenyls (2025) Müller L, Zehetmeier A, Höfling A, Gaß H, Voß J, Krappmann D, Rockmann L, et al. Journal article, Original article Efficient treatment of long-range electrostatics in charge equilibration approaches (2025) Savvidi K, Ahrens-Iwers L, Colombi Ciacchi L, Zahn D, Müser MH, Meißner RH Journal article On the pK of crystal surfaces: molecular modeling of crystallite protonation, local reorganization, and solute dissociation (2025) Duchstein P, Macht M, Zahn D Journal article An Automated Workflow to Discover the Structure-Stability Relations for Radiation Hard Molecular Semiconductors (2025) Bornschlegl A, Duchstein P, Wu J, Rocha-Ortiz JS, Caicedo-Reina M, Ortiz A, Insuasty B, et al. Journal article Reversible chirality inversion of an AuAgx-cysteine coordination polymer by pH change (2024) Ni B, Vivod D, Avaro J, Qi H, Zahn D, Wang X, Cölfen H Journal article Assessing Solid Catalysts with Ionic Liquid Layers (SCILL) from Molecular Dynamics Simulations: On the Role of Local Charge Polarization (2024) Trzeciak S, Zahn D Journal article Nucleation Behavior of SnS2 on Thiol Functionalized SAMs During Solution-Based Atomic Layer Deposition (2024) Götz K, Prihoda A, Shen C, Dierner M, Dallmann J, Prusch S, Zahn D, et al. Journal article Local Charge Distribution in GaxPdy Intermetallics: Characterizing Catalyst Surfaces from Large-Scale Molecular Mechanics Simulations (2024) Wonglakhon T, Maisel S, Görling A, Zahn D Journal article