AC department publications

Pan, H., A. Trunschke, Y. Wang and R. Ouyang: Unraveling the Temperature Effects on the Raman Spectra of V₂O₅ by Combining Machine Learning and Molecular Dynamics. The Journal of Physical Chemistry Letters 17 (15), 4459–4466 (2026).

Vuijk, M., J. Zeininger, L. Sandoval Diaz, G. Rupprechter, B. Roldan Cuenya, K. Reuter, T. Lunkenbein and C. Scheurer: Multiscale Microscopy via Automation: Dual Magnification Environmental Scanning Electron Microscopy Imaging by Frame Alternation. Advanced Materials Technologies, in press.

Beshara, G.-M., T. Heinrich, A. Pitzer, K. Engel, K. Raue, F. Krumeich, W.J. Stark, D. Teschner and J. Pérez-Ramírez: Gold-Modified Rare Earth Oxides with Tunable Lattice Oxygen Reactivity for N₂O Synthesis. ACS Catalysis 16 (7), 6509–6524 (2026).

Boniface, M., T. Götsch, J. Dong, J. Kröhnert, E. Frei, A. Trunschke, R. Schlögl, B. Roldan Cuenya and T. Lunkenbein: Dynamics of a Cu/ZnO/Al₂O₃ catalyst revealed by operando transmission electron microscopy during CO₂ hydrogenation. Nature Catalysis, in press.

Schumann, J., H. Näsström, M. Götte, L. Himanen, A. Moshantaf, M. Scheidgen, J.A. Márquez, C. Draxl and A. Trunschke: Enabling open and FAIR catalysis data with standardized data structures. Nature Catalysis 9 (3), 225–229 (2026).

Ali, H., P. König, X.Q. Tran, A. Kaus, H. Türk, A. Hammud, Z. Gheisari, V. Vibhu, V. Roddatis, F. Schmidt, R. Blume, P. Zeller, T. Frömling, F. Gunkel, A. Knop-Gericke, K. Reuter, R.-A. Eichel, C. Scheurer and T. Lunkenbein: Interfacial Atomic and Electronic Structures of LSM/YSZ Thin Films as Models for SOC Air Electrodes. ChemElectroChem 13 (6), e202500343 (2026).

Falling, L.J., M. Huber, J. Reich, M. Krinninger, S. Kaiser, M. Döblinger, M. Rötzer, M. Krause, A. Shavorskiy, S. Zhu, U. Heiz, H. Bluhm, F. Esch and B.A.J. Lechner: Evolution of Size-Selected Pt Cluster Catalysts on Prototypical Oxide Supports. Faraday Discussions, in press.

Duarte Correa, L.J., F. Girgsdies, K. Skorupska, T. Lunkenbein and W. Hetaba: Electron beam-induced transformation of LDH and derived materials. Micron 202, 103985 (2026).

Fickl, B., W. Artner, D. Matulka, J. Rath, M. Nastran, M. Hofer, R. Blume, M. Hävecker, A. Kirnbauer, F. Fahrnberger, H. Hutter, D. Zhang, P.H. Mayrhofer, A. Knop-Gericke, B. Roldan Cuenya, R. Schlögl, C. Dipolt, D. Eder and B.C. Bayer: Realizing Scalable Chemical Vapor Deposition of Monolayer Graphene Films on Iron with Concurrent Surface Hardening by In Situ Observations. ACS Applied Materials & Interfaces 18 (5), 8567–8579 (2026).

Sandoval Diaz, L., T. Götsch, D. Cruz, M. Vuijk, J.M. Lombardi, M. Pietsch, K. Dembélé, A. Hammud, K. Reuter, C. Scheurer, A. Knop-Gericke and T. Lunkenbein: Stabilizing Frustrated Phase Transitions in Selective Oxidation Reactions. Advanced Materials 38 (8), e15292 (2026).

Abdiaziz, K., L. Ni, D. Demirbas, H. Haak, E. Reijerse, P. Theis, W. Jiang, S. Chabbra, T. Lunkenbein, U.I. Kramm and A. Schnegg: Reversibly Redox Active Iron Oxide Structures in FeNC Catalysts Identified by Microscopy and Spectroelectrochemical EPR and Mössbauer Methods. Journal of the American Chemical Society 148 (4), 3995–4007 (2026).

He, T., D. Benetti, C. Tseng, B. Moss, D. Teschner, T.E. Jones, A. Kafizas, M. Grätzel, S. Piccinin and J.R. Durrant: Observation of Transition from Rate Law to Butler-Volmer Controlled Water Oxidation Kinetics on Hematite Photoanodes. Journal of the American Chemical Society, in press.

Öztuna, E., T. Götsch, D. Cruz, P. Zeller, O.V. Vinogradova, Z. Li, C. Rohner, F. Schmidt, Z. Gheisari, A. Steigert, M. Muske, M. Hävecker, E. Stotz, I. Antonyshyn, F. Girgsdies, O. Timpe, T. Lunkenbein, V.J. Bukas, K. Reuter, R. Schlögl, K. Skorupska, A. Knop-Gericke and B. Roldan Cuenya: Operando X-ray Spectroscopy Study of Pd and Pd-Au Laterally Condensed Catalysts during Selective Acetylene Hydrogenation: The Role of Carbon. Advanced Materials, in press.

Silva, A., D. Teschner, T. Jones and S. Piccinin: Charge accumulation and solvation in β-NiOOH: Surface chemistry of an OER catalyst from ML-aided simulations. The Journal of Chemical Physics 164 (1), 014701 (2026).

Mendes, P.S.F., N. López, S. De, R. Fushimi, R. Yildrim and A. Trunschke: Data as a Key Resource in Catalysis: A Community Account. ChemCatChem 17 (24), e01226 (2025).

Götsch, T., D. Cruz, P. Zeller, A. Rabe, M. Dreyer, N. Cosanne, F. Girgsdies, J. Allan, M. Hävecker, A. Efimenko, M. Gorgoi, S. Najafishirtari, M. Behrens, R. Schlögl, A. Knop-Gericke and T. Lunkenbein: Local solid-state processes adjust the selectivity in catalytic oxidation reactions on cobalt oxides. Nature Catalysis 8 (12), 1314–1324 (2025).

Rabe, A., F. Schmidt, S. Rafiezadeh, S. Salamon, J. Landers, M. Eckhardt, C. Pratsch, B. Beckmann, F. Haase, D. Kordus, M. Lopez-Luna, C. Rettenmaier, T. Götsch, A. Knop-Gericke, A. Bergmann, J. Timoshenko, B. Roldan Cuenya, O. Gutfleisch, M. Zobel, R. Pentcheva, H. Wende, T. Lunkenbein and M. Behrens: Metastable Crystalline Cobalt Iron Oxide Nano-Flakes with Antiferromagnetic/Ferrimagnetic Composition Mosaicity. Angewandte Chemie International Edition 64 (48), e202504171 (2025).

Asadi, Z., C.P. Marshall, A. Trunschke and T. Risse: Revealing the Active State of a Cu/ZnO:Al Catalyst During Reverse Water-Gas Shift Reaction in an Operando Microwave Absorption Study. Angewandte Chemie International Edition 64 (46), 2202504280 (2025).

Kafi, N., A. Rodrigues, I. Häusler, H. Ma, C. Netzel, A. Hammud, O. Skibitzki, M. Schmidbauer and F. Hatami: Broadband light emission from GaAsP and GaInP islands grown on silicon nanotip wafer via nanoheteroepitaxy. Applied Physics Letters 127 (19), 191106 (2025).

Nguyen, V.C., E. Ortega, D. Cruz, J. Zhu, W. Frandsen, S.K. Shaikhutdinov and B. Roldan Cuenya: Structure and Reactivity of Cu₂O Nanocubes in Ethanol Dehydrogenation. ACS Catalysis 15 (21), 18333–18347 (2025).