Department Chemie und Pharmazie

Benchmark Reference Data and Computational Protocols for Predicting Excitation Energies of Thioindigoid Photoswitches (2026) Harrer E, Müller C, Zahn D Journal article The Python simulations of chemistry framework: 10 years of an open-source quantum chemistry project (2026) Sun Q, Hermes MR, Wu X, Zhai H, Zhang X, Ahmed AM, Aucar JJ, et al. Journal article Surface oxidation of Ru(10-10) and Pt–Ru/Ru(10-10) electrocatalysts and its effect on the hydrogen evolution reaction (2026) Hübsch R, Schauermann D, Škvára J, Reindl S, Skála T, Tsud N, Retzer T, et al. Journal article Photocontrolled Isomerization Pathways of Tolylsulfonyl- and Pyrene-Linked Norbornadiene Systems Driven by Absorption Band Targeting (2026) Sun D, Krappmann D, Oleszak C, Lienert J, Slavov C, Hirsch A, Wachtveitl J Journal article A robust and versatile hot injection synthesis of catalytically active gallium-based bimetallic nanoparticles with low size polydispersity (2026) Jimenez Sanchez MA, Englhard J, Bachmann J, Moritz M, Madubuko N, Taccardi N, Carl S, et al. Journal article, Report Long-Lived Interfacial Charge Separation in Pyrenylimidazolyl Phthalocyanine@Transition Metal Dichalchogenide Heterostructures (2026) Mack E, Gamelas SR, Tomé AC, Tomé JP, Harrer E, Zahn D, Lourenço LM, Guldi DM Journal article Domino Strategies in Heterocycle Synthesis: Advancing from Organocatalysis to Photo-/Organo-Autocatalysis (2026) Al-Romema A, Heckmann F, Tsogoeva S Journal article, Review article Potential-Averaged ΔSCF Methods: Underlying Formalism and Evaluation of Accuracy of Excitation Energies (2026) Trushin E, Bertleff O, Görling A Journal article Structure-Based Adaptation of a SARS-CoV-2 Neutralizing Peptide to New Virus Variants (2026) Raasch N, Weißenborn L, Richel E, Schäfer S, Denysenko O, Bartelsen N, Sticht H, et al. Journal article Functional Nanoparticles for the Magnetic Removal of Critical Phthalates from Water (2026) Voß J, Prusch S, Valencia Villacís LA, Fröhlich J, Müller L, Dreyer S, Rockmann L, et al. Journal article