Scientific Publications

Cheraparambil, H.; Vega-Paredes, M.; Scheu, C.; Weidenthaler, C.: Unraveling the Evolution of Dynamic Active Sites of LaNi_xFe_1–xO₃ Catalysts During OER. ACS Applied Materials and Interfaces (2024)

Van Stappen, C.; Van Kuiken, B. E.; Mörtel, M.; Ruotsalainen, K. O.; Maganas, D.; Khusniyarov, M. M.; DeBeer, S.: Correlating Valence and 2p3d RIXS Spectroscopies: A Ligand-Field Study of Spin-Crossover Iron(II). Inorganic Chemistry 63 (16), pp. 7386 - 7400 (2024)

Wang, Y.; Kumar, A.; Budiyanto, E.; Cheraparambil, H.; Weidenthaler, C.; Tüysüz, H.: Boron-Incorporated Cobalt–Nickel Oxide Nanosheets for Electrochemical Oxygen Evolution Reaction. ACS Applied Energy Materials 7 (8), pp. 3145 - 3156 (2024)

Mei, Z.-L.; Li, C.-C.; Han, X.; Tian, Y.-C.; Li, S.-H.; Liu, W.; Qu, G.; Reetz, M. T.; Sun, Z.; Ma, J.-A. et al.; Zhang, F.-G.: Enzymatic Stereodivergent Access to Fluorinated β-Lactam Pharmacophores via Triple-Parameter Engineered Ketoreductases. ACS Catalysis 14 (8), pp. 6358 - 6368 (2024)

Qiu, G.: Exceptions, Paradoxes, and Their Resolutions in Chemical Reactivity. ChemRxiv: the Preprint Server for Chemistry (2024)

Yadav, O.; Kumar, M.; Mohapatra, R. K.; Gupta, M. K.; Ansari, M.; Ansari, A.: Mechanistic insights on the epoxidation of alkenes by high-valent non-heme Fe(IV) and Fe(V) oxidants: a comparative theoretical study. New Journal of Chemistry 48 (14), pp. 6132 - 6141 (2024)

Ansari, M.; Bhattacharjee, S.; Pantazis, D. A.: Correlating Structure with Spectroscopy in Ascorbate Peroxidase Compound II. Journal of the American Chemical Society 146 (14), pp. 9640 - 9656 (2024)

Qiao, Y.; Shi, E.; Wei, X.; Hou, Z.: Ionic liquid-stabilized metal oxoclusters: from design to catalytic application. Green Chemistry (2024)

Cai, Y.; Gaurav, G.; Ritter, T.: 1,4-Aminoarylation of Butadienes via Photoinduced Palladium Catalysis. Angewandte Chemie International Edition 63 (14), e202311250 (2024)

Reichle, S.; Kang, L.; Demirbas, D.; Weidenthaler, C.; Felderhoff, M.; DeBeer, S.; Schüth, F.: Mechanocatalytic Synthesis of Ammonia: State of the Catalyst During Reaction and Deactivation Pathway. Angewandte Chemie International Edition 63 (14), e202317038 (2024)

Schulte, Y.; Wölper, C.; Rupf, S. M.; Malischewski, M.; SantaLucia, D. J.; Neese, F.; Haberhauer, G.; Schulz, S.: Structural characterization and reactivity of a room-temperature-stable, antiaromatic cyclopentadienyl cation salt. Nature Chemistry 16 (4), pp. 651 - 657 (2024)

Büker, J.; Shang, J.; Angel, S.; Budiyanto, E.; Tüysüz, H.; Wiggers, H.; Schulz, C.; Grünewald, M.; Peng, B.; Muhler, M.: Tert-butyl hydroperoxide decomposition as a descriptor for liquid-phase hydrocarbon oxidation over transition metal oxide-based catalysts: a screening study (GH-12158WP). ARKIVOC 2024 (3), 202312158 (2024)

Lococciolo, G.; Guptka, S. K.; Dechert, S.; Demeshko, S.; Duboc, C.; Atanasov, M.; Neese, F.; Meyer, F.: Oxygen-Donor Metalloligands Induce Slow Magnetization Relaxation in Zero Field for a Cobalt(II) Complex with {CoO4} Motif. Inorganic Chemistry 63 (12), pp. 5652 - 5663 (2024)

Bodach, A.; Portet, A.; Winkelmann, F.; Herrmann, B.; Gallou, F.; Ponnusamy, E.; Virieux, D.; Colacino, E.; Felderhoff, M.: Scalability of Pharmaceutical Co-Crystal Formation by Mechanochemistry in batch. ChemSusChem 17 (6), e202301220 (2024)

Palme, P. R.; Goddard, R.; Imming, P.; Seidel, R. W.: Structural Characterization of 4-(4-Nitrophenyl)thiomorpholine, a Precursor in Medicinal Chemistry. Molbank 2024 (1), M1795 (2024)

Lee, J.; Kumar, A.; Tüysüz, H.: Solar-Light-Driven Photocatalytic Oxidative Coupling of Phenol Derivatives over Bismuth-Based Porous Metal Halide Perovskites. Angewandte Chemie International Edition, e202404496 (2024)

Gasevic, T.; Kleine Büning, J. B.; Grimme, S.; Bursch, M.: Benchmark Study on the Calculation of ²⁰⁷Pb NMR Chemical Shifts. Inorganic Chemistry 63 (11), pp. 5052 - 5064 (2024)

Lang, M.; Ganapathy, U. S.; Mann, L.; Seidel, R. W.; Goddard, R.; Erdmann, F.; Dick, T.; Richter, A.: Synthesis and in vitro Metabolic Stability of Sterically Shielded Antimycobacterial Phenylalanine Amides. ChemMedChem 19 (6), e202300593 (2024)

Kondyli, A.; Schrader, W.: Investigation of the Behavior of Hydrocarbons during Crude Oil Fouling by High-Resolution Electrospray Ionization Mass Spectrometry. Energies 17 (6), 1299 (2024)

Cheraparambil, H.; Vega-Paredes, M.; Wang, Y.; Tüysüz, H.; Scheu, C.; Weidenthaler, C.: Deciphering the role of Fe impurities in the electrolyte boosting the OER activity of LaNiO₃. Journal of Materials Chemistry A 12 (9), pp. 5194 - 5203 (2024)