Wissenschaftliche Publikationen

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 63 (23), e202404496 (2024)

Bhattacharjee, S.; Arra, S.; Daidone, I.; Pantazis, D. A.: Excitation landscape of the CP43 photosynthetic antenna complex from multiscale simulations. Chemical Science 15 (19), S. 7269 - 7284 (2024)

Pesara, P.; Szafran, K.; Nguyen, H. C.; Sirohiwal, A.; Pantazis, D. A.; Gabruk, M.: Elucidating substrate binding in the light-dependent protochlorophyllide oxidoreductase. Chemical Science 15 (20), S. 7767 - 7780 (2024)

Onur, E.; Lee, J.; Aymerich-Armengol, R.; Lim, J.; Dai, Y.; Tüysüz, H.; Scheu, C.; Weidenthaler, C.: Exploring the Effects of the Photochromic Response and Crystallization on the Local Structure of Noncrystalline Niobium Oxide. ACS Applied Materials and Interfaces 16 (19), S. 25136 - 25147 (2024)

Gasevic, T.; Bursch, M.; Ma, Q.; Grimme, S.; Werner, H.-J.; Hansen, A.: The p-block challenge: assessing quantum chemistry methods for inorganic heterocycle dimerizations. Physical Chemistry Chemical Physics 26 (18), S. 13884 - 13908 (2024)

Kaur, H.; Rauscher, S. A.; Werner, E.; Song, Y.; Yi, J.; Kazöne, W.; Martin, W. F.; Tüysüz, H.; Moran, J.: A prebiotic Krebs cycle analog generates amino acids with H₂ and NH₃ over nickel. Chem 10 (5), S. 1528 - 1540 (2024)

Bistoni, G.; Altun, A.; Wang, Z.; Neese, F.: Local Energy Decomposition Analysis of London Dispersion Effects: From Simple Model Dimers to Complex Biomolecular Assemblies. Accounts of Chemical Research 57 (9), S. 1411 - 1420 (2024)

Ni, S.; Halder, R.; Ahmadli, D.; Reijerse, E. J.; Cornella, J.; Ritter, T.: C–heteroatom coupling with electron-rich aryls enabled by nickel catalysis and light. Nature Catalysis (2024)

Qiao, Y.; Shi, E.; Wei, X.; Hou, Z.: Ionic liquid-stabilized metal oxoclusters: from design to catalytic application. Green Chemistry 26 (9), S. 5127 - 5149 (2024)

Rütter, D.; van Gastel, M.; Leutzsch, M.; Nöthling, N.; SantaLucia, D.; Neese, F.; Fürstner, A.: Molybdenum(VI) Nitrido Complexes with Tripodal Silanolate Ligands. Structure and Electronic Character of an Unsymmetrical Dimolybdenum μ-Nitrido Complex Formed by Incomplete Nitrogen Atom Transfer. Inorganic Chemistry 63 (18), S. 8376 - 8389 (2024)

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 16 (17), S. 21997 - 22006 (2024)

Mateos, J.; Schulte, T.; Behera, D.; Leutzsch, M.; Altun, A.; Sato, T.; Waldbach, F.; Schnegg, A.; Neese, F.; Ritter, T.: Nitrate reduction enables safer aryldiazonium chemistry. Science 384 (6694), S. 446 - 452 (2024)

Qiu, Z.; Deng, H.; Neumann, C. N.: Site-Isolated Rhodium(II) Metalloradicals Catalyze Olefin Hydrofunctionalization. Angewandte Chemie International Edition 63 (18), e202401375 (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), S. 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), S. 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), S. 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), S. 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), S. 9640 - 9656 (2024)

Seidel, R. W.; Goddard, R.; Lang, M.; Richter, A.: Nα-Aroyl-N-Aryl-Phenylalanine Amides: A Promising Class of Antimycobacterial Agents Targeting the RNA Polymerase. Chemistry and Biodiversity, e202400267 (2024)