Journal Article (156)
2024
Journal Article
Pantazis, D. A.; Intermolecular Photoinduced Electron Transfer in Biosystems: Impact of Conformational Transitions and Multiple Channels on Kinetics. ChemPhotoChem 2024, 8, e202300307.
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Neese, F.; The Spin-Forbidden Transition in Iron(IV)-Oxo Catalysts Relevant to Two-State Reactivity. Science Advances 2024, 10, eado1603.
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Leyser da Costa Gouveia, T.; Maganas, D.; Neese, F. Restricted Open-Shell Hartree–Fock Method for a General Configuration State Function Featuring Arbitrarily Complex Spin-Couplings. The Journal of Physical Chemistry A 2024, 128, 5041–5053.
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Reetz, M. T. Learning from Protein Engineering by Deconvolution of Multi-Mutational Variants. Angewandte Chemie International Edition 2024, e202404880.
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Schulte, T.; Wang, Z.; Li, C.-C.; Hamad, A.; Waldbach, F.; Pampel, J.; Petzold, R.; Leutzsch, M.; ; Ritter, T. Ruthenium Phenoxo Complexes: An Isolobal Ligand to Cp with Improved Properties. Journal of the American Chemical Society 2024, 146, 15825–15832.
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Belthle, K. S.; ; Tüysüz, H. Synergistic Effects of Silica-Supported Iron−Cobalt Catalysts for CO2 Reduction to Prebiotic Organics. ChemCatChem 2024, 16, e202301218.
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Lechner, M. H.; Papadopoulos, A.; Sivalingam, K.; Auer, A. A.; Koslowski, A.; Becker, U.; Wennmohs, F.; Neese, F. Code Generation in ORCA: Progress, Efficiency and Tight Integration. Physical Chemistry Chemical Physics 2024, 26, 15205–15220.
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Hamad, A.; Mrozowicz, M.; Xie, Y.; Ritter, T. Regioselective Double C–H Functionalization of Arenes Via Aryl Thianthrenium Salt Analogues. Synlett 2024, 35, 1028–1032.
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Spinnato, D.; Leutzsch, M.; Wang, F.; Cornella, J. Internal Atom Exchange in Oxazole Rings: A Blueprint for Azole Scaffold Evaluation. Synlett 2024, 35, 1015–1018.
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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 2024, 63, e202404496.
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Felderhoff, M.; Unstable Metal Hydrides for Possible On-Board Hydrogen Storage. Hydrogen 2024, 5, 241–279.
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Ni, S.; Halder, R.; Ahmadli, D.; ; Cornella, J.; Ritter, T. C–Heteroatom Coupling with Electron-Rich Aryls Enabled by Nickel Catalysis and Light. Nature Catalysis 2024, 7, 733–741.
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Goddard, R.; The Pseudo Symmetric Crystal Structure of 1,4-Diazabicyclo[2·2·2]Octane-1,4-Diium bis(5-Hydroxy-2,4-Dinitrophenolate). Journal of Chemical Crystallography 2024, 54, 125–131.
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Goddard, R.; ; Nα-Aroyl-N-Aryl-Phenylalanine Amides: A Promising Class of Antimycobacterial Agents Targeting the RNA Polymerase. Chemistry and Biodiversity 2024, 21, e202400267.
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Bhattacharjee, S.; ; ; Pantazis, D. A. Excitation Landscape of the CP43 Photosynthetic Antenna Complex from Multiscale Simulations. Chemical Science 2024, 15, 7269–7284.
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Pesara, P.; ; ; ; Pantazis, D. A.; Elucidating Substrate Binding in the Light-Dependent Protochlorophyllide Oxidoreductase. Chemical Science 2024, 15, 7767–7780.
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Wang, Z.; Pushing the Limit of Photo-Controlled Polymerization: Hyperchromic and Bathochromic Effects. Molecules 2024, 29, 2377.
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Onur, E.; Lee, J.; ; ; Dai, Y.; Tüysüz, H.; ; Weidenthaler, C. Exploring the Effects of the Photochromic Response and Crystallization on the Local Structure of Noncrystalline Niobium Oxide. ACS Applied Materials and Interfaces 2024, 16, 25136–25147.
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Bursch, M.; ; ; ; The p-Block Challenge: Assessing Quantum Chemistry Methods for Inorganic Heterocycle Dimerizations. Physical Chemistry Chemical Physics 2024, 26, 13884–13908.
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Song, Y.; ; ; ; Tüysüz, H.; A Prebiotic Krebs Cycle Analog Generates Amino Acids with H2 and NH3 over Nickel. Chem 2024, 10, 1528–1540.
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