Journal Article (146)

2023
Journal Article
Foglia, N.; De Souza, B.; Maganas, D.; Neese, F. Including Vibrational Effects in Magnetic Circular Dichroism Spectrum Calculations in the Framework of Excited State Dynamics. The Journal of Chemical Physics 2023, 158, 154108.
Journal Article
Onur Şahin, E.; Zhang, S.; Scheu, C.; Weidenthaler, C. Sodium Tantalates: Monitoring Crystallization Via in Situ Total X-Ray Scattering. CrystEngComm 2023, 25, 2256–2263.
Journal Article
Lang, M.; Ganapathy, U. S.; Mann, L.; Abdelaziz, R.; Seidel, R. W.; Goddard, R.; Sequenzia, I.; Hoenke, S.; Schulze, P.; Aragaw, W. W.; Csuk, R.; Dick, T.; Richter, A. Synthesis and Characterization of Phenylalanine Amides Active against Mycobacterium Abscessus and Other Mycobacteria. Journal of Medicinal Chemistry 2023, 66, 5079–5098.
Journal Article
Altun, A.; Riplinger, C.; Neese, F.; Bistoni, G. Exploring the Accuracy Limits of PNO-Based Local Coupled-Cluster Calculations for Transition-Metal Complexes. Journal of Chemical Theory and Computation 2023, 19, 2039–2047.
Journal Article
Capone, M.; Sirohiwal, A.; Aschi, M.; Pantazis, D. A.; Daidone, I. Alternative Fast and Slow Primary Charge-Separation Pathways in Photosystem II. Angewandte Chemie International Edition 2023, 62, e202216276.
Journal Article
Piani, R.; Beele, B. B.; Rust, J.; Lehmann, C. W.; Mohr, F. Coinage Metal Complexes Containing Perfluorinated Carboxylates. Chemistry 2023, 5, 813–833.
Journal Article
Li, A.; Wang, Q.; Song, X.; Zhang, X.; Huang, J.-W.; Chen, C.-C.; Guo, R.-T.; Wang, B.; Reetz, M. T. Engineering of a P450-Based Kemp Eliminase with a New Mechanism. Chinese Journal of Catalysis 2023, 47, 191–199.
Journal Article
Guo, Y.; Pavošević, F.; Sivalingam, K.; Becker, U.; Valeev, E. F.; Neese, F. SparseMaps—A Systematic Infrastructure for Reduced-Scaling Electronic Structure Methods. VI. Linear-Scaling Explicitly Correlated N-Electron Valence State Perturbation Theory with Pair Natural Orbital. The Journal of Chemical Physics 2023, 158, 124120.
Journal Article
Wu, Z.; Tüysüz, H.; Besenbacher, F.; Dai, Y.; Xiong, Y. Recent Developments in Lead-Free Bismuth-Based Halide Perovskite Nanomaterials for Heterogeneous Photocatalysis under Visible Light. Nanoscale 2023, 15, 5598–5622.
Journal Article
Grimm, J. A. A.; Zhou, H.; Properzi, R.; Leutzsch, M.; Bistoni, G.; Nienhaus, J.; List, B. Catalytic Asymmetric Synthesis of Cannabinoids and Menthol from Neral. Nature 2023, 615, 634–639.
Journal Article
Yang, X.; Reijerse, E. J.; Nöthling, N.; SantaLucia, D. J.; Leutzsch, M.; Schnegg, A.; Cornella, J. Synthesis, Isolation, and Characterization of Two Cationic Organobismuth(II) Pincer Complexes Relevant in Radical Redox Chemistry. Journal of the American Chemical Society 2023, 145, 5618–5623.
Journal Article
Gunnarson, A.; de Bellis, J.; Imhof, T.; Pfänder, N.; Ledendecker, M.; Schüth, F. Facile Solid-State Synthesis of Supported PtNi and PtCo Bimetallic Nanoparticles for the Oxygen Reduction Reaction. Chemistry of Materials 2023, 35, 2006–2015.
Journal Article
Spohr, S. M.; Fürstner, A. Studies Toward Providencin: The Furanyl-Cyclobutanol Segment. Organic Letters 2023, 25, 1536–1540.
Journal Article
Zhou, H.; Properzi, R.; Leutzsch, M.; Belanzoni, P.; Bistoni, G.; Tsuji, N.; Han, J. T.; Zhu, C.; List, B. Organocatalytic DYKAT of Si-Stereogenic Silanes. Journal of the American Chemical Society 2023, 145, 4994–5000.
Journal Article
Krebs, M. L.; Bodach, A.; Wang, C.; Schüth, F. Stabilization of Alkaline 5-HMF Electrolytes Via Cannizzaro Reaction for the Electrochemical Oxidation to FDCA. Green Chemistry 2023, 25, 1797–1802.
Journal Article
Tsuji, N.; Sidorov, P.; Zhu, C.; Nagata, Y.; Gimadiev, T.; Varnek, A.; List, B. Predicting Highly Enantioselective Catalysts Using Tunable Fragment Descriptors. Angewandte Chemie International Edition 2023, 62, e202218659.
Journal Article
Koh, E. S.; Geiger, S.; Gunnarson, A.; Imhof, T.; Meyer, G. M.; Paciok, P.; Etzold, B. J. M.; Rose, M.; Schüth, F.; Ledendecker, M. Influence of Support Material on the Structural Evolution of Copper during Electrochemical CO2 Reduction. ChemElectroChem 2023, 10, e202200924.
Journal Article
Marlow, F.; Josten, S.; Leiting, S. Electronics with Stainless Steel: The Work Functions. Journal of Applied Physics 2023, 133, 085104.
Journal Article
Belthle, K. S.; Tüysüz, H. Linking Catalysis in Biochemical and Geochemical CO2 Fixation at the Emergence of Life. ChemCatChem 2023, 15, e202201462.
Journal Article
Weller, R.; Atanasov, M.; Demeshko, S.; Chen, T.-Y.; Mohelsky, I.; Bill, E.; Orlita, M.; Meyer, F.; Neese, F.; Werncke, C. G. On the Single-Molecule Magnetic Behavior of Linear Iron(I) Arylsilylamides. Inorganic Chemistry 2023, 62, 3153–3161.