Journal Article (156)

2024
Journal Article
Zanetti-Polzi, L.; Pantazis, D. A.; Daidone, I. Intermolecular Photoinduced Electron Transfer in Biosystems: Impact of Conformational Transitions and Multiple Channels on Kinetics. ChemPhotoChem 2024, 8, e202300307.
Journal Article
Rice, D. B.; Wong, D.; Weyhermüller, T.; Neese, F.; DeBeer, S. The Spin-Forbidden Transition in Iron(IV)-Oxo Catalysts Relevant to Two-State Reactivity. Science Advances 2024, 10, eado1603.
Journal Article
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.
Journal Article
Hollmann, F.; Sanchis Martinez, J.; Reetz, M. T. Learning from Protein Engineering by Deconvolution of Multi-Mutational Variants. Angewandte Chemie International Edition 2024, e202404880.
Journal Article
Schulte, T.; Wang, Z.; Li, C.-C.; Hamad, A.; Waldbach, F.; Pampel, J.; Petzold, R.; Leutzsch, M.; Bahns, F.; Ritter, T. Ruthenium Phenoxo Complexes: An Isolobal Ligand to Cp with Improved Properties. Journal of the American Chemical Society 2024, 146, 15825–15832.
Journal Article
Belthle, K. S.; Martin, W. F.; Tüysüz, H. Synergistic Effects of Silica-Supported Iron−Cobalt Catalysts for CO2 Reduction to Prebiotic Organics. ChemCatChem 2024, 16, e202301218.
Journal Article
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.
Journal Article
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.
Journal Article
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.
Journal Article
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.
Journal Article
Cao, Z.; Habermann, F.; Burkmann, K.; Felderhoff, M.; Mertens, F. Unstable Metal Hydrides for Possible On-Board Hydrogen Storage. Hydrogen 2024, 5, 241–279.
Journal Article
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, 7, 733–741.
Journal Article
Seidel, R. W.; Goddard, R.; Kolev, T. M. 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.
Journal Article
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 2024, 21, e202400267.
Journal Article
Bhattacharjee, S.; Arra, S.; Daidone, I.; Pantazis, D. A. Excitation Landscape of the CP43 Photosynthetic Antenna Complex from Multiscale Simulations. Chemical Science 2024, 15, 7269–7284.
Journal Article
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 2024, 15, 7767–7780.
Journal Article
Wang, Z.; Zhang, Z.; Wu, C.; Wang, Z.; Liu, W. Pushing the Limit of Photo-Controlled Polymerization: Hyperchromic and Bathochromic Effects. Molecules 2024, 29, 2377.
Journal Article
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 2024, 16, 25136–25147.
Journal Article
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 2024, 26, 13884–13908.
Journal Article
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 2024, 10, 1528–1540.
Go to Editor View