Publikationen des Fritz-Haber-Instituts (2001-)

Zeitschriftenartikel (204)

2023
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Abou-Ras, D., U. Bloeck, S. Caicedo-Dávila, A. Eljarrat, H. Funk, A. Hammud, S. Thomas, D.R. Wargulski, T. Lunkenbein und C.T. Koch: Correlative microscopy and monitoring of segregation processes in optoelectronic semiconductor materials and devices. Journal of Applied Physics 133 (12), 121101 (2023).
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Abramiuc, L.E., L.C. Tanase, M. Prieto, L.de S. Caldas, A. Tiwari, N.G. Apostol, M.A. Huşanu, C.F. Chirilă, L. Trupină, T. Schmidt, L. Pintilie und C.M. Teodorescu: Surface charge dynamics on air-exposed ferroelectric Pb(Zr,Ti)O3(001) thin films. Nanoscale 15 (31), 13062–13075 (2023).
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Ali, H., B. Winter und R. Seidel: The Metal-Oxide Nanoparticle-Aqueous Solution Interface Studied by Liquid-Microjet Photoemission. Accounts of Chemical Research 56 (13), 1687–1697 (2023).
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Almalla, A., L. Elomaa, L. Bechtella, A. Daneshgar, P. Yavvari, Z. Mahfouz, P. Tang, B. Koksch, I. Sauer, K. Pagel, K.H. Hillebrandt und M. Weinhart: Papain-Based Solubilization of Decellularized Extracellular Matrix for the Preparation of Bioactive, Thermosensitive Pregels. Biomacromolecules 24 (12), 5620–5637 (2023).
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Amirbeigiarab, R., J. Tian , A. Herzog, C. Qiu, A. Bergmann, B. Roldan Cuenya und O.M. Magnussen: Atomic-scale surface restructuring of copper electrodes under CO2 electroreduction conditions. Nature Catalysis 6 (9), 837–846 (2023).
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Angel, S., M. Braun, B. Alkan, J. Landers, S. Salamon, H. Wende, C. Andronescu, C. Schulz und H. Wiggers: Spray-Flame Synthesis of LaFexCo1-xO3 (x = 0.2, 0.3) Perovskite Nanoparticles for Oxygen Evolution Reaction in Water Splitting: Effect of Precursor Chemistry (Acetates and Nitrates). The Journal of Physical Chemistry A 127 (11), 2564–2576 (2023).
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Anníes, S., C. Scheurer und C. Panosetti: The intrinsic electrostatic dielectric behaviour of graphite anodes in Li-ion batteries-Across the entire functional range of charge. Electrochimica Acta 444, 141966 (2023).
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Antonyshyn, I., O. Sichevych, U. Burkhardt, A.M.B. Jiménez, A. Melendez-Sans, Y.-F. Liao, K.-D. Tsuei, D. Kasinathan, D. Takegami und A. Ormeci: Al-Pt intermetallic compounds: HAXPES study. Physical Chemistry Chemical Physics 25 (45), 31137–31145 (2023).
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Balos, V., M. Wolf, S. Kovalev und M. Sajadi: Optical rectification and electro-optic sampling in quartz. Optics Express 31 (8), 13317 (2023).
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Barreto, J., N. Nilius, H. Tissot, S.K. Shaikhutdinov, H.-J. Freund und F. Stavale: Interaction of water and carbon monoxide with MnO(001) thin films on Au(111). Physical Chemistry Chemical Physics 25 (43), 29808–29815 (2023).
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Bechtella, L. und K. Pagel: A butterfly effect: From a single nucleotide to altered immunity. Chem 9 (3), 554–556 (2023).
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Behovits, Y., A. Chekhov, S.Y. Bodnar, O. Gückstock, S. Reimers, Y. Lytvynenko, Y. Skourski, M. Wolf, T. Seifert, O. Gomonay, M. Kläui, M. Jourdan und T. Kampfrath: Terahertz Néel spin-orbit torques drive nonlinear magnon dynamics in antiferromagnetic Mn2Au. Nature Communications 14, 6038 (2023).
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Beinlich, S., G. Kastlunger, K. Reuter und N. Hörmann: Controlled Electrochemical Barrier Calculations without Potential Control. Journal of Chemical Theory and Computation 19 (22), 8323–8331 (2023).
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Bergmann, N., N. Hörmann und K. Reuter: Ab Initio-Based Modeling of Thermodynamic Cyclic Voltammograms: A Benchmark Study on Ag(100) in Bromide Solutions. Journal of Chemical Theory and Computation 19 (23), 8815–8825 (2023).
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Beynon, O.T., A. Owens, C. Carbogno und A.J. Logsdail: Evaluating the Role of Anharmonic Vibrations in Zeolite β Materials. The Journal of Physical Chemistry C 127 (32), 16030–16040 (2023).
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Biswajit, M., A. Jana, J. Roy, A.C. Mata, A.S. Nair, A. Mahendranath, S. Roy, B. Pathak, P.M. Ajayan und T. Pradeep: Structure and Electrocatalytic Performance of Cocrystallized Ternary Molybdenum Oxosulfide Clusters for Efficient Water Splitting. ACS Materials Letters 5 (12), 3306–3315 (2023).
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Blume, R., W. Calvet, A. Ghafari, T. Mayer, A. Knop-Gericke und R. Schlögl: Structural and Chemical Properties of NiOx Thin Films: Oxygen Vacancy Formation in O2 Atmosphere. ChemPhysChem 24 (23), e202300231 (2023).
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Blume, R., W. Wolfram, A. Ghafari, T. Mayer, A. Knop-Gericke und R. Schlögl: Structural and chemical properties of NiOx thin films: the role of oxygen vacancies in NiOOH formation in a H2O atmosphere. Physical Chemistry Chemical Physics 25 (37), 25552–25565 (2023).
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Bonati , L., D. Polino, C. Pizzolitto, P. Biasi, R. Eckert, S. Reitmeier, R. Schlögl und M. Parrinello: The role of dynamics in heterogeneous catalysis: Surface diffusivity and N2 decomposition on Fe(111). Proceedings of the National Academy of Sciences of the United States of America 120 (50), e231302312 (2023).
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Bude, R., I. Verschueren, I. Florea, J.-L. Maurice, P. Legagneux, L.M.C. Pereira, H. Bana, R. Villarreal, R. Blume, A. Knop-Gericke, T. Jones und D. Pribat: Synthesis of Few-Layered Transition-Metal Dichalcogenides by Ion Implantation of Chalcogen and Metal Species into Sapphire. ACS Omega 8 (32), 29475–29484 (2023).
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Buttersack, T., H. Haak, H. Bluhm, U. Hergenhahn, G. Meijer und B. Winter: Imaging temperature and thickness of thin planar liquid water jets in vacuum. Structural Dynamics 10 (3), 034901 (2023).
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Calati, S., Q. Li, X. Zhu und J. Stähler: Dynamic screening of quasiparticles in WS2 monolayers. Physical Review B 107 (11), 115404 (2023).
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Carbonio, E., F. Sulzmann, A. Klyushin, M. Hävecker, S. Piccinin, A. Knop-Gericke, R. Schlögl und T. Jones: Adjusting the Chemical Reactivity of Oxygen for Propylene Epoxidation on Silver by Rational Design: The Use of an Oxyanion and Cl. ACS Catalysis 13 (9), 5906–5913 (2023).
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Chee, S.W., T. Lunkenbein, R. Schlögl und B. Roldan Cuenya: Operando Electron Microscopy of Catalysts: The Missing Cornerstone in Heterogeneous Catalysis Research? Chemical Reviews 123 (23), 13374–13418 (2023).
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Chen, K., C. Kunkel, B. Cheng, K. Reuter und J. Margraf: Physics-inspired machine learning of localized intensive properties. Chemical Science 14 (18), 4913–4922 (2023).
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Chen, Z., X. Wang, Z.-K. Han, S. Zhang, S. Pollastri, Q. Fan, Z. Qu, D. Sarker, C. Scheu, M. Huang und H. Cölfen: Aufdeckung des Entstehungsmechanismus und Optimierung der Synthesebedingungen von geschichteten Doppelhydroxiden für die Sauerstoffentwicklungsreaktion. Angewandte Chemie 135 (10), e202215728 (2023).
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Chen, Z., X. Wang, Z.-K. Han, S. Zhang, S. Pollastri, Q. Fan, Z. Qu, D. Sarker, C. Scheu, M. Huang und H. Cölfen: Revealing the Formation Mechanism and Optimizing the Synthesis Conditions of Layered Double Hydroxides for the Oxygen Evolution Reaction. Angewandte Chemie International Edition 62 (10), e202215728 (2023).
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Cheng, R., X. Shen, S. Klotz, Z. Zeng, Z. Li, A. Ivanov, Y. Xiao, L.-D. Zhao, F. Weber und C. Yue: Lattice dynamics and thermal transport of PbTe under high pressure. Physical Review B 108 (10), 104306 (2023).
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Christiansen, D., M. Selig, M. Rossi und A. Knorr: Optical classification of excitonic phases in molecular functionalized atomically-thin semiconductors. Physical Review B 107 (4), L041401 (2023).
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Davis, E., A. Bergmann, C. Zhan, H. Kuhlenbeck und B. Roldan Cuenya: Comparative study of Co3O4(111), CoFe2O4(111), and Fe3O4(111) thin film electrocatalysts for the oxygen evolution reaction. Nature Communications 14, 4791 (2023).
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de Luna, G.S., T. Tommaso, J. Velasco Vélez, E. Monti, F. Ospitali, S. Albonetti, F. Cavani, G. Fornasari und P. Benito: Electrification of glucose valorization over NiO/Ni foam. Sustainable Energy & Fuels 7 (18), 4474–4485 (2023).
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de Luna, G.S., P. Zeller, E. Öztuna, F. Maluta, A. Canciani, F. Ospitali, P.H. Ho, A. Paglianti, A. Knop-Gericke, G. Fornasari, J. Velasco Vélez und P. Benito: In Situ Development of a 3D Cu-CeO2 Catalyst Selective in the Electrocatalytic Hydrogenation of Biomass Furanic Compounds. ACS Catalysis 13 (19), 12737–12745 (2023).
Zeitschriftenartikel
Dean, J., M. Scheffler, T. Purcell, S.V. Barabash, R. Bhowmik und T. Bazhirov: Interpretable Machine Learning for Materials Design. Journal of Materials Research 38 (20), 4477–4496 (2023).
Zeitschriftenartikel
Deka, N., T.E. Jones, L.J. Falling, L. Sandoval Diaz, T. Lunkenbein, J.-J. Velasco-Velez, T.-S. Chan, C.-H. Chuang, A. Knop-Gericke und R.V. Mom: On the Operando Structure of Ruthenium Oxides during the Oxygen Evolution Reaction in Acidic Media. ACS Catalysis 13 (11), 7488–7498 (2023).
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Demling, A., S.B. King, P. Shushkov und J. Stähler: O2 Reduction at a DMSO/Cu(111) Model Battery Interface. The Journal of Physical Chemistry C 127 (6), 2894–2900 (2023).
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Diego, G., M.D. Higham, M.G. Quesne, M. Aramini, R. Xu, A.I. Large, G. Held, J. Velasco Vélez, M. Hävecker, A. Knop-Gericke, C. Genovese, C. Ampelli, M.E. Schuster, S. Perathoner, G. Centi, C.R.A. Catlow und R. Arrigo: Interfacial Chemistry in the Electrocatalytic Hydrogenation of CO2 over C-Supported Cu-Based Systems. ACS Catalysis 13 (9), 5876–5895 (2023).
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Dong, S., S. Beaulieu, M. Selig, P. Rosenzweig, D. Christiansen, T. Pincelli, M.R. Dendzik, J.D. Ziegler, J. Maklar, R.P. Xian, A. Neef, A. Mohammed, A. Schulz, M. Stadler, M. Jetter, P. Michler, T. Taniguchi, K. Watanabe, H. Takagi, U. Starke, A. Chernikov, M. Wolf, H. Nakamura, A. Knorr, L. Rettig und R. Ernstorfer: Observation of ultrafast interfacial Meitner-Auger energy transfer in a van der Waals heterostructure. Nature Communications 14, 5057 (2023).
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Dortaj, S. und S. Matera: Efficient global sensitivity analysis of kinetic Monte Carlo simulations using Cramérs-von Mises distance. The Journal of Chemical Physics 159 (9), 094110 (2023).
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Dudzinski, A.M., A. Dudzinski, E. Diesen, H. Heenen, V.J. Bukas und K. Reuter: First Step of the Oxygen Reduction Reaction on Au(111): A Computational Study of O2 Adsorption at the Electrified Metal/Water Interface. ACS Catalysis 13 (18), 12074–12081 (2023).
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Dupuy, R., J. Filser, C. Richter, T. Buttersack, F. Trinter, S. Gholami, R. Seidel, C. Nicolas, J. Bozek, D. Egger, H. Oberhofer, S. Thürmer, U. Hergenhahn, K. Reuter, B. Winter und H. Bluhm: Ångstrom-Depth Resolution with Chemical Specificity at the Liquid-Vapor Interface. Physical Review Letters 130 (15), 156901 (2023).
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Dupuy, R., J. Filser, C. Richter, R. Seidel, F. Trinter, T. Buttersack, C. Nicolas, J. Bozek, U. Hergenhahn, H. Oberhofer, B. Winter, K. Reuter und H. Bluhm: Correction: Photoelectron angular distributions as sensitive probes of surfactant layer structure at the liquid-vapor interface. Physical Chemistry Chemical Physics 25 (33), 22538–22538 (2023).
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Dupuy, R., S. Thürmer, C. Richter, T. Buttersack, F. Trinter, B. Winter und H. Bluhm: Core-Level Photoelectron Angular Distributions at the Liquid–Vapor Interface. Accounts of Chemical Research 56 (3), 215–223 (2023).
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Eggert, T., N. Hörmann und K. Reuter: Cavity formation at metal-water interfaces. The Journal of Chemical Physics 159 (19), 194702 (2023).
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Esquius, J.R., D.J. Morgan, G. Algara-Siller, D. Gianolio, M. Aramini, L. Lahn, O. Kasian, S.A. Kondrat, R. Schlögl, G.J. Hutchings, R. Arrigo und S.J. Freakley: Lithium-Directed Transformation of Amorphous Iridium (Oxy)hydroxides To Produce Active Water Oxidation Catalysts. Journal of the American Chemical Society 145 (11), 6398–6409 (2023).
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Fang, L., C. Chen, X. Lu und W. Ren: Effects of pressure and temperature on topological electronic materials X2Y3 (X = As, Sb, Bi; Y = Se, Te) using first-principles. Physical Chemistry Chemical Physics 25 (31), 20969–20978 (2023).
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Fellows, A.P., V. Balos, B. John, A. Diaz Duque, M. Wolf und M. Thämer: Obtaining extended insight into molecular systems by probing multiple pathways in second-order nonlinear spectroscopy. The Journal of Chemical Physics 159 (16), 164201 (2023).
Zeitschriftenartikel
Fidanyan, K., G. Liu und M. Rossi: Ab initio study of water dissociation on a charged Pd(111) surface. The Journal of Chemical Physics 158 (9), 094707 (2023).
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Fielicke, A.: Probing the binding and activation of small molecules by gas-phase transition metal clusters via IR spectroscopy. Chemical Society Reviews 52 (11), 3778–3841 (2023).
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Foppa, L., Rüther Frederik, M. Geske, G. Koch, F. Girgsdies, P. Kube, S. Carey, M. Hävecker, O. Timpe, A. Tarasov, M. Scheffler, F. Rosowski, R. Schlögl und A. Trunschke: Data-Centric Heterogeneous Catalysis: Identifying Rules and Materials Genes of Alkane Selective Oxidation. Journal of the American Chemical Society 145 (6), 3427–3442 (2023).
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Frenzel, M., M. Cherasse, J. Urban, F. Wang, B. Xiang, L. Nest, L. Huber, L. Perfetti, M. Wolf, T. Kampfrath, X.-Y. Zhu und S.F. Maehrlein: Nonlinear terahertz control of the lead halide perovskite lattice. Science Advances 9 (21), eadg3856 (2023).
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