Journal Article (276)
2019
Journal Article
Puppin, M., Y. Deng, C. Nicholson, J. Feldl, N. Schröter, H. Vita, , C. Monney, L. Rettig, M. Wolf and R. Ernstorfer: Time- and angle-resolved photoemission spectroscopy of solids in the extreme ultraviolet at 500 kHz repetition rate. Review of Scientific Instruments 90 (02), 023104 (2019).
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Qiu, H., H. Kuhlenbeck, and H.-J. Freund: Gold-Decorated Biphase α-Fe2O3(0001): Activation by CO-Induced Surface Reduction. The Journal of Physical Chemistry C 123 (13), 8221–8227 (2019).
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Raimbault, N., and M. Rossi: Anharmonic effects in the low-frequency vibrational modes of aspirin and paracetamol crystals. Physical Review Materials 3 (05), 053605 (2019).
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Raimbault, N., , and M. Rossi: Using Gaussian Process Regression to Simulate the Vibrational Raman Spectra of Molecular Crystals. New Journal of Physics 21 (10), 105001 (2019).
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C. Winta, , , N. Paßler, , , I. Razdolski, , , , , , , , , , , , , , , M. Wolf, A. Paarmann and : Controlling the Infrared Dielectric Function through Atomic-Scale Heterostructures. ACS Nano 13 (6), 6730–6741 (2019).
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Razdolski, I., , and : Ultrafast transport and relaxation of hot plasmonic electrons in metal-dielectric heterostructures. Physical Review B 100 (4), 045412 (2019).
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D. Sarker and : Manipulating Localized Vibrations of Interstitial Te for Ultra-High Thermoelectric Efficiency in p-Type Cu–In–Te Systems. ACS Applied Materials and Interfaces 11 (35), 32192–32199 (2019).
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Rettig, L., , , , , , , , , , , , , , , , , , , , , and : Disentangling transient charge order from structural dynamics contributions during coherent atomic motion studied by ultrafast resonant x-ray diffraction. Physical Review B 99 (13), 134302 (2019).
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F.E. Feiten, J. Pal, A. Plucienik, E. Emmez, S.K. Shaikhutdinov, H. Kuhlenbeck, , H.-J. Freund, , and : Characterization of Phonon Vibrations of Silica Bilayer Films. The Journal of Physical Chemistry C 123 (12), 7110–7117 (2019).
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Rizo Parraga, R. and B. Roldan Cuenya: Shape-Controlled Nanoparticles as Anodic Catalysts in Low Temperature Fuel Cells. ACS Energy Letters 4 (6), 1484–1495 (2019).
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C. Massué, T. Lunkenbein, , , and : The role of synthesis conditions for structural defects and lattice strain in β-TaON and their effect on photo- and photoelectrocatalysis. Zeitschrift für Naturforschung B 74 (1), 71–83 (2019).
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Ronneburg, H., , , , S. Cap, and : Surface structure inhibited lithiation of crystalline silicon probed with operando neutron reflectivity. Energy Storage Materials 18, 182–189 (2019).
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Sauceda, H.E., , , and : Molecular force fields with gradient-domain machine learning: Construction and application to dynamics of small molecules with coupled cluster forces. The Journal of Chemical Physics 150 (11), 114102 (2019).
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Scherzer, M., F. Girgsdies, E. Stotz, M.G. Willinger, E. Frei, R. Schlögl, and T. Lunkenbein: Electrochemical Surface Oxidation of Copper Studied by in Situ Grazing Incidence X-ray Diffraction. The Journal of Physical Chemistry C 123 (21), 13253–13262 (2019).
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S.V. Levchenko, , , , , , , , M. Scheffler, and : Step-flow growth in homoepitaxy of β-Ga2O3 (100)-The influence of the miscut direction and faceting. APL Materials 7 (2), 022515 (2019).
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Schlögl, R.: Put the Sun in the Tank: Future Developments in Sustainable Energy Systems. Angewandte Chemie International Edition 58 (1), 343–348 (2019).
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Schlögl, R.: Pack die Sonne in den Tank: Zur Weiterentwicklung nachhaltiger Energiesysteme. Angewandte Chemie 131 (1), 349–354 (2019).
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Schmidt, T., H. Marchetto, , and E. Umbach: Complex Monolayer Growth Dynamics of a Highly Symmetric Molecule: NTCDA on Ag(111). The Journal of Physical Chemistry C 123 (13), 8244–8255 (2019).
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Scholten, F., , and B. Roldan Cuenya: Plasma-Modified Dendritic Cu Catalyst for CO2 Electroreduction. ACS Catalysis 9 (6), 5496–5502 (2019).
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Seiler, H., S. Palato, , , , and : Two-dimensional electronic spectroscopy reveals liquid-like lineshape dynamics in CsPbI3 perovskite nanocrystals. Nature Communications 10, 4962 (2019).
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Shang, H., , , , , C. Carbogno, M. Scheffler and : Electron-phonon coupling in d-electron solids: A temperature-dependent study of rutile TiO2 by first-principles theory and two-photon photoemission. Physical Review Research 1 (3), 033153 (2019).
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Shen, T., , I.Y. Zhang and M. Scheffler: Massive-parallel Implementation of the Resolution-of-Identity Coupled-cluster Approaches in the Numeric Atom-centered Orbital Framework for Molecular Systems. Journal of Chemical Theory and Computation 15 (9), 4721–4734 (2019).
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A. Knop-Gericke, and : Mechanistic Studies of Gas Reactions with Multicomponent Solids: What Can We Learn By Combining NAP XPS and Atomic Resolution STEM/EDX? The Journal of Physical Chemistry C 123 (43), 26201–26210 (2019).
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H.-J. Freund, S.K. Shaikhutdinov and : Acetylene Reactivity on Pd-Cu Nanoparticles Supported on Thin Silica Films: The Role of the Underlying Substrate. The Journal of Physical Chemistry C 123 (28), 17425–17431 (2019).
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R. Schlögl and : Facile Protocol for Alkaline Electrolyte Purification and Its Influence on a Ni–Co Oxide Catalyst for the Oxygen Evolution Reaction. ACS Catalysis 9, 8165–8170 (2019).
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D. Teschner and : Experimental Activity Descriptors for Iridium-Based Catalysts for the Electrochemical Oxygen Evolution Reaction (OER). ACS Catalysis 9, 6653–6663 (2019).
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S.K. Shaikhutdinov, M. Heyde, T. Schmidt and H.-J. Freund: Interaction of water with oxide thin film model systems. Journal of Materials Research 34 (3), 360–378 (2019).
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R. Ernstorfer, and R.P. Xian: Multidimensional Contrast Limited Adaptive Histogram Equalization. IEEE Access 7, 165437–165447 (2019).
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M. Rupp, and : Chemical diversity in molecular orbital energy predictions with kernel ridge regression. The Journal of Chemical Physics 150 (20), 204121 (2019).
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Sutton, C.A., L.M. Ghiringhelli, , , , , , X. Liu, A. Ziletti and M. Scheffler: Crowd-sourcing materials-science challenges with the NOMAD 2018 Kaggle competition. npj Computational Materials 5, 111 (2019).
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Tarasov, A., F. Seitz, R. Schlögl and E. Frei: In Situ Quantification of Reaction Adsorbates in Low-Temperature Methanol Synthesis on a High-Performance Cu/ZnO:Al Catalyst. ACS Catalysis 9 (6), 5537–5544 (2019).
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T. Jones, , , K. Skorupska, R. Mom, , , A. Knop-Gericke, R. Schlögl, and : Evolution of Oxygen–Metal Electron Transfer and Metal Electronic States During Manganese Oxide Catalyzed Water Oxidation Revealed with In Situ Soft X‐Ray Spectroscopy. Angewandte Chemie International Edition 58 (11), 3426–3432 (2019).
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T. Jones, , , K. Skorupska, R. Mom, , , A. Knop-Gericke, R. Schlögl, and : Evolution of Oxygen–Metal Electron Transfer and Metal Electronic States During Manganese Oxide Catalyzed Water Oxidation Revealed with In Situ Soft X-Ray Spectroscopy. Angewandte Chemie 131 (11), 3464–3470 (2019).
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Thämer, M., T. Garling, R.K. Campen and M. Wolf: Quantitative determination of the nonlinear bulk and surface response from alpha-quartz using phase sensitive SFG spectroscopy. The Journal of Chemical Physics 151 (6), 064707 (2019).
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Thomas, D., E. Mucha, M. Lettow, G. Meijer, M. Rossi and G.von Helden: Characterization of a trans-trans Carbonic Acid-Fluoride Complex by Infrared Action Spectroscopy in Helium Nanodroplets. Journal of the American Chemical Society 141 (14), 5815–5823 (2019).
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Y. Wang, A. Tarasov, A. Trunschke and R. Schlögl: Oxygen Activation in Oxidative Coupling of Methane on Calcium Oxide. The Journal of Physical Chemistry C 123 (13), 8018–8026 (2019).
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B. Roldan Cuenya: Is There a Negative Thermal Expansion in Supported Metal Nanoparticles? An in Situ X-ray Absorption Study Coupled with Neural Network Analysis. The Journal of Physical Chemistry C 123 (33), 20594–20604 (2019).
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Timoshenko, J. and : “Inverting” X-ray Absorption Spectra of Catalysts by Machine Learning in Search for Activity Descriptors. ACS Catalysis 9 (11), 10192–10211 (2019).
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Truppe, S., S. Marx, S. Kray, M. Doppelbauer, S. Hofsäss, H.C. Schewe, N. Walter, J. Pérez-Ríos, and G. Meijer: Spectroscopic characterization of aluminum monofluoride with relevance to laser cooling and trapping. Physical Review A 100 (5), 052513 (2019).
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K. Pagel: Exploring the Potential of Dendritic Oligoglycerol Detergents for Protein Mass Spectrometry. Journal of the American Society for Mass Spectrometry 30 (1), 174–180 (2019).
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K. Pagel: Switchable Solubility of Azobenzene-Based Bolaamphiphiles. ChemPhysChem 20 (13), 1690–1697 (2019).
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W. Schöllkopf, , , A. Fielicke and : Hydrogen Chemisorption on Doubly Vanadium Doped Aluminum Clusters. Zeitschrift für Physikalische Chemie 233 (6), 799–812 (2019).
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Vasileiadis, T., , , , D. Zahn, F. Krecinic, , and R. Ernstorfer: Ultrafast rotational motions of supported nanoclusters probed by electron diffraction. Nanoscale Horizons 4 (5), 1164–1173 (2019).
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Velasco Vélez, J., T. Jones, D. Gao, E. Carbonio, , , , , , , , B. Roldan Cuenya, R. Schlögl, A. Knop-Gericke and : The Role of the Copper Oxidation State in the Electrocatalytic Reduction of CO2 into Valuable Hydrocarbons. ACS Sustainable Chemistry & Engineering 7 (1), 1485–1492 (2019).
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Velasco Vélez, J., T. Jones, V. Streibel, , , , , , , , , , , R. Schlögl and A. Knop-Gericke: Electrochemically active Ir NPs on graphene for OER in acidic aqueous electrolyte investigated by in situ and ex situ spectroscopies. Surface Science 681, 1–8 (2019).
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Vempati, S.P.K., J.-C. Deinert, L. Gierster, L. Bogner, C. Richter, , , , , , , and J. Stähler: Uncovering the (un-)occupied electronic structure of a buried hybrid interface. Journal of Physics: Condensed Matter 31 (9), 094001 (2019).
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M. Hävecker, K. Skorupska, , , and : Redox Behavior of Solid Solutions in the SrFe1‐xCuxO3‐δ System for Application in Thermochemical Oxygen Storage and Air Separation. Energy Technology 7 (1), 131–139 (2019).
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S. Böttcher, H. Vita, K. Horn, , and : Electronic Structure and Magnetic Properties of Graphene/Ni3Mn/Ni(111) Trilayer. The Journal of Physical Chemistry C 123 (8), 4994–5002 (2019).
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N. Ferri, , , A. Tkatchenko, and : Quantitative imaging of electric surface potentials with single-atom sensitivity. Nature Materials 18 (8), 853–859 (2019).
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Wang, H., S.V. Levchenko, , , M. Scheffler and M. Rossi: Modulation of the Work Function by the Atomic Structure of Strong Organic Electron Acceptors on H‐Si(111). Advanced Electronic Materials 5 (5), 1800891 (2019).