Publikationen des MPI für Kohlenforschung

Ruggieri, S.; Carneiro Neto, A. N.; Santos Jr., C. V.; Moura Jr., R. T.; Bettinelli, M.; Piccinelli, F. Effect of the ligand polarizability on the hypersensitive ⁵D₀→⁷F₂ transition of Eu(III) in nitrate complexes with nitrogen-based ligands. Optical Materials (Amsterdam, Neth.) 2026, 174, 117939.

Liu, X.; Moon, H. W.; Cornella, J. Reduction of Nitroarenes to Anilines with an Air-Stable Bismuth Catalyst. Synthesis 2026, 58, 1003–1006.

Juelsholt, M.; Glei Graversen, L.; Bhai, L.; Svirinovsky-Arbeli, A.; Park, S.; DuBridge, T.; Leiting, S.; Karlsen, M. A.; Etter, M.; Lusardi, M.; Weidenthaler, C.; Marbella, L. E. In Situ X-ray Diffraction during Ball Milling Reveals Poorly Crystalline Metastable Intermediates during the Formation of Disordered Rocksalt Oxyfluorides. Journal of the American Chemical Society 2026, 148, 17044–17058.

Lu, J.; Zheng, T.; Matsutani, S.; Tsuji, N.; Zhu, C.; Leutzsch, M.; List, B. Confined Acids Catalyze a Broadly Applicable β-Selective O-Glycosylation. Journal of the American Chemical Society 2026, 148, 16594–16598.

Malagutti, M. A.; Camps, R. E.; Anselmi-Tamburini, U.; Dinnebier, R. E.; Weidenthaler, C.; Scardi, P.; Maduro de Campos, C. E. Effect of Oxidation on the Mechanochemical Synthesis of Bismuth Telluride Nanophases, Ex Situ and In Situ Structural Characterization, and Thermoelectric Properties. ACS Applied Energy Materials 2026.

Nikodemus, J.; Ren, Y.; Kappel, I.; Ott, F.; Weidenthaler, C.; Keenan, L.; Hausoul, P. J. C.; Palkoyits, R. Telomerization of Isoprene with Short Alcohols Using Novel Solid Molecular Phosphine Polymers. ChemCatChem 2026, 18, e70732.

Arissa, A.; Rose, T.; Leick, N.; Kucheryavy, P.; Ouyang, J.; He, H.; Grimme, S.; Johnson, J. C.; Lockard, J. V. Pore-Selective Fullerene Loading in a Porphyrin-Based Metal–Organic Framework Controls Photoinduced Charge-Transfer Dynamics. The Journal of Physical Chemistry Letters 2026, 17, 4811–4819.

Harabuchi, Y.; Staub, R.; Gao, M.; Tsuji, N.; List, B.; Varnek, A.; Maeda, S. Predicting Enantioselectivity via Kinetic Simulations on Gigantic Reaction Path Networks. ACS Central Science 2026, 12, 524–531.

Tenhumberg, L.; Schrader, W.; Vetere, A. Development of a Nanoscaled Ion Source for High-Sensitivity Photoionization Mass Spectrometry. Analytical Chemistry 2026, 98, 11044–11053.

Juelsholt, M. Continued challenges in high-throughput materials predictions: MatterGen predicts compounds from the training dataset. Materials Horizons 2026.

Euringer, L.; Franz, M.; Holzapfel, M.; Krummenacher, I.; Neubert, C.; Braunschweig, H.; Neese, F.; Richert, S.; Lambert, C. Electron Transfer and Exchange Interactions in Mixed-Valence Radical Anions, Radical Cations, and Neutral Diradicals Derived from Bridged Bis-Triarylmethyl Systems. The Journal of Physical Chemistry B 2026, 130, 4162–4177.

Mertdinç-Ülküseven , S.; Demirbas, D.; Süzer-Çiçek, İ.; Padberg, G.; Felderhoff, M.; Kutluay, S.; Öveçoğlu , M. L.; Ağaoğulları, D. A few layers graphene encapsulated Fe-based nanoparticles synthesized from ferrocene containing precursors: CVD optimization and evaluation for possible nanocatalyst performance towards H₂ production. International Journal of Hydrogen Energy 2026, 226, 154476.

Han, J. T.; List, B. Acid-Catalyzed Synthesis of Si-Stereogenic Silanes. Chinese Journal of Chemistry 2026, 44, 1212–1222.

Levi, G.; Kroesbergen, M.; Thirion, L.; Schmerwitz, Y. L. A.; Jónsson, E. Ö.; Bilous, P.; Hansmann, P.; Jónsson, H. Orbital Optimization and Neural-Network-Assisted Configuration Interaction Calculations of Rydberg States. Journal of Chemical Theory and Computation 2026, 22, 3260–3267.

Qiu, Z.; Neumann, C. N. Rhodium(II) Porphyrins: Unusual Transition States and the Quest for Catalytic Turnover. ChemCatChem 2026, 18, e70725.

Schmerwitz, Y. L. A.; Selenius, E.; Levi, G. Freeze-and-Release Direct Optimization Method for Variational Calculations of Excited Electronic States. Journal of Chemical Theory and Computation 2026, 22, 3571–3584.

Béland, V. A.; Stamoulis, A. G.; Nöthling, N.; Cornella, J. Controlling the Redox Speciation of N,C,N−Bi Complexes Using the Anion Coordination Index. Organometallics 2026, 45, 902–911.

Cui, M.; Fürstner, A. A Convenient, Safe, and Atom-Economical Route to a Large Portfolio of Grubbs-Type Catalysts for Olefin Metathesis via Four-Coordinate Ruthenium Alkylidynes. Angewandte Chemie International Edition 2026, 65, e6803845.

Barasits, F.; Qiu, G. Diagnosing Quantum Tunneling at Ambient Temperature through Rate–Driving Force Responsiveness. ChemRxiv: the Preprint Server for Chemistry 2026.

Roh, B.; Williams, B. A.; Cornella, J. Ambiphilic cross-coupling with aryl-bismuth reagents. Nature 2026.