Zeitschriftenartikel (276)
2019
Zeitschriftenartikel
, , K. Reuter und : Special Topic on Interfacial Electrochemistry and (Photo)electrocatalysis. The Journal of Chemical Physics 150 (4), 041401 (2019).
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Lin, C., , , M. Rossi und T. Kumagai: Real-Space Observation of Quantum Tunneling by a Carbon Atom: Flipping Reaction of Formaldehyde on Cu(110). The Journal of Physical Chemistry Letters 10 (3), 645–649 (2019).
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Lin, C., , , und T. Kumagai: Real-space observation of far- and near-field-induced photolysis of molecular oxygen on an Ag(110) surface by visible light. The Journal of Chemical Physics 151 (14), 144705 (2019).
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, , , , , , , , , und D.S. Su: Highly Efficient Metal-Free Nitrogen-Doped Nanocarbons with Unexpected Active Sites for Aerobic Catalytic Reactions. ACS Nano 13 (12), 13995–14004 (2019).
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, , , , , R. Schlögl und : Sauerstoffentwicklungsreaktion an Kohlenstoffkanten: Aktivitätsentwicklungund Struktur-Eigenschafts-Beziehungen, untersucht anhand polyzyklischer aromatischer Kohlenwasserstoffe. Angewandte Chemie 131 (26), 9010–9014 (2019).
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, , , , , R. Schlögl und : Oxygen Evolution Reaction at Carbon Edge Sites: Investigartion of Activity Evolution and Structure‐Function Relationships Clarified by Polycyclic Aromatic Hydrocarbons. Angewandte Chemie International Edition 58 (26), 8917–8921 (2019).
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Litman, Y., , T. Kumagai und M. Rossi: Elucidating the Nuclear Quantum Dynamics of Intramolecular Double Hydrogen Transfer in Porphycene. Journal of the American Chemical Society 141 (6), 2526–2534 (2019).
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Liu, S., M. Müller, , , A. Hammud, M. Wolf und T. Kumagai: Resolving the Correlation between Tip-Enhanced Resonance Raman Scattering and Local Electronic States with 1 nm Resolution. Nano Letters 19 (8), 5725–5731 (2019).
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, , , X. Huang und : In-situ fabrication of nitrogen-doped carbon nanosheets containing highly dispersed single iron atoms for oxygen reduction reaction. Journal of Power Sources 412, 125–133 (2019).
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, , , , , K.R. Asmis, , C. Baldauf, und : Structure and Reactivity of Al−O(H)−Al Moieties in Siloxide Frameworks: Solution and Gas‐Phase Model Studies. Angewandte Chemie International Edition 58 (3), 902–906 (2019).
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, , , , , , , C. Baldauf, und : Struktur und Reaktivität der Al‐O(H)‐Al‐Einheiten in Siloxidgerüstverbindungen – Modellstudien in Lösung und in Isolation. Angewandte Chemie 131 (3), 912–917 (2019).
Zeitschriftenartikel
, , F. Cheenicode Kabeer, , und : Nonadditivity of the Adsorption Energies of Linear Acenes on Au(111): Molecular Anisotropy and Many-Body Effects. The Journal of Physical Chemistry Letters 10 (5), 1000–1004 (2019).
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Manz, C., M. Grabarics, F. Hoberg, M. Pugini, , und K. Pagel: Separation of isomeric glycans by ion mobility spectrometry-the impact of fluorescent labelling. Analyst 144 (17), 5292–5298 (2019).
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, und K. Reuter: Towards Density Functional Approximations from Coupled Cluster Correlation Energy Densities. The Journal of Chemical Physics 150 (24), 244116 (2019).
Zeitschriftenartikel
und K. Reuter: Systematic Enumeration of Elementary Reaction Steps in Surface Catalysis. ACS Omega 4 (2), 3370–3379 (2019).
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Marianski, M., J. Seo, E. Mucha, D. Thomas, S. Jung, R. Schlögl, G. Meijer, A. Trunschke und G.von Helden: Structural Characterization of Molybdenum Oxide Nanoclusters Using Ion Mobility Spectrometry-Mass Spectrometry and Infrared Action Spectroscopy. The Journal of Physical Chemistry C 123 (13), 7845–7853 (2019).
Zeitschriftenartikel
, , , , , , , , , B. Roldan Cuenya, und : Role of Boron and Phosphorus in Enhanced Electrocatalytic Oxygen Evolution by Nickel Borides and Nickel Phosphides. ChemElectroChem 6 (1), 235–240 (2019).
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und K. Reuter: Computational design of metal-supported molecular switches: transient ion formation during light- and electron-induced isomerisation of azobenzene. Journal of Physics: Condensed Matter 31 (4), 044003 (2019).
Zeitschriftenartikel
, , R.K. Campen und : Vibrational spectra of dissociatively adsorbed D2O on Al-terminated α-Al2O3(0001) surfaces from ab initio molecular dynamics. The Journal of Chemical Physics 150 (24), 244701 (2019).
Zeitschriftenartikel
, , , , , , R. Schlögl, und : Helical cobalt borophosphates to master durable overall water-splitting. Energy & Environmental Science 12 (3), 988–999 (2019).
Zeitschriftenartikel
Menzel, D.: Organized under the auspices of the International Field Emission Society June 10th–15th, 2018, Gaithersburg, Maryland, United States: Atom Probe Tomography and Microscopy, APT&M 2018. Microscopy and Microanalysis 25 (Special Issue 2), 269–273 (2019).
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, , , , , D. Teschner, , , und : Influence of Surface State on the Electrochemical Performance of Nickel-Based Cermet Electrodes during Steam Electrolysis. ACS Applied Energy Materials 2 (10), 7045–7055 (2019).
Zeitschriftenartikel
und K. Reuter: Efficient simulation of near-edge x-ray absorption fine structure (NEXAFS) in density-functional theory: Comparison of core-level constraining approaches. The Journal of Chemical Physics 150 (7), 074104 (2019).
Zeitschriftenartikel
Millet, M.-M., G. Algara-Siller, S. Wrabetz, A. Mazheika, F. Girgsdies, D. Teschner, , A. Tarasov, S.V. Levchenko, R. Schlögl und E. Frei: Ni Single Atom Catalysts for CO2 Activation. Journal of the American Chemical Society 141 (6), 2451–2461 (2019).
Zeitschriftenartikel
Millet, M.-M., A. Tarasov, F. Girgsdies, G. Algara-Siller, R. Schlögl und E. Frei: Highly dispersed Ni0/NixMg1-xO catalysts derived from solid solutions: How metal and support control the CO2 hydrogenation. ACS Catalysis 9 (9), 8534–8546 (2019).
Zeitschriftenartikel
Mom, R., L. Frevel, J. Velasco Vélez, M. Plodinec, A. Knop-Gericke und R. Schlögl: The Oxidation of Platinum under Wet Conditions Observed by Electrochemical X-ray Photoelectron Spectroscopy. Journal of the American Chemical Society 141 (16), 6537–6544 (2019).
Zeitschriftenartikel
Mortazavi, M., , , , , und : Computational polymorph screening reveals late-appearing and poorly-soluble form of rotigotine. Communications Chemistry 2, 70 (2019).
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Mucha, E., A. Stuckmann, M. Marianski, , G. Meijer und K. Pagel: In-depth structural analysis of glycans in the gas phase. Chemical Science 10 (5), 1272–1284 (2019).
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, , , , , , , , , K. Horn und : Influence of interface dipole layers on the performance of graphene field effect transistors. Carbon 152, 680–687 (2019).
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, , , , O. Gückstock, S.M. Rouzegar, T. Seifert, , T. Kampfrath und : Antenna-coupled spintronic terahertz emitters driven by a 1550 nm femtosecond laser oscillator. Applied Physics Letters 115 (02), 022405 (2019).
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, , , , , , und S. Curtarolo: AFLOW-QHA3P: Robust and automated method to compute thermodynamic properties of solids. Physical Review Materials 3 (7), 073801 (2019).
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Nicholson, C., M. Puppin, , , M. Krenz, , L. Rettig, R. Ernstorfer und M. Wolf: Excited-state band mapping and momentum-resolved ultrafast population dynamics in In/Si(111) nanowires investigated with XUV-based time- and angle-resolved photoemission spectroscopy. Physical Review B 99 (15), 155107 (2019).
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, , , D. Sarker, , und : New low temperature environmental friendly process for the synthesis of tetragonal MoO2 and its field emission properties. Applied Surface Science 467-468, 1148–1156 (2019).
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Noel, J., , und A.S. Mikhailov: Polymer-like Model to Study the Dynamics of Dynamin Filaments on Deformable Membrane Tubes. Biophysical Journal 117 (10), 1870–1891 (2019).
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, , , B. Roldan Cuenya und : Water Solvation of Charged and Neutral Gold Nanoparticles. The Journal of Physical Chemistry B 123 (30), 6521–6528 (2019).
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, M. Rupp, , , , , , und : Machine-learned multi-system surrogate models for materials prediction. npj Computational Materials 5, 51 (2019).
Zeitschriftenartikel
, und K. Reuter: Ab Initio Thermodynamics Insight into the Structural Evolution of Working IrO2 Catalysts in Proton-Exchange Membrane Electrolyzers. ACS Catalysis 9 (6), 4944–4950 (2019).
Zeitschriftenartikel
Ouyang, R., E. Ahmetcik, C. Carbogno, M. Scheffler und L.M. Ghiringhelli: Simultaneous learning of several materials properties from incomplete databases with multi-task SISSO. JPhys Materials 2 (2), 024002 (2019).
Zeitschriftenartikel
, , A. Klyushin, , und : Pd-Cu/HOPG and Pd-Ag/HOPG Model Catalysts in CO and Methanol Oxidations at Submillibar Pressures. Kinetics and Catalysis 60 (6), 832–841 (2019).
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, , , , , , M. Plodinec, , , A. Hammud, D. Ivanov, , M.G. Willinger, und : ZnO@TiO2 Core Shell Nanorod Arrays with Tailored Structural, Electrical, and Optical Properties for Photovoltaic Application. Molecules 24 (21), 3965 (2019).
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, , , , , R. Schlögl, , und : Insights into Water Interaction at the Interface of Nitrogen-Functionalized Hydrothermal Carbons. The Journal of Physical Chemistry C 123 (41), 25146–25156 (2019).
Zeitschriftenartikel
Paßler, N. und A. Paarmann: Generalized 4 × 4 matrix formalism for light propagation in anisotropic stratified media: study of surface phonon polaritons in polar dielectric heterostructures: erratum [J. Opt. Soc. Am. B 34, 2128 (2017)]. Journal of the Optical Society of America B 36 (11), 3246–3248 (2019).
Zeitschriftenartikel
Paßler, N., I. Razdolski, , , , M. Wolf und A. Paarmann: Second Harmonic Generation from Phononic Epsilon-Near-Zero Berreman Modes in Ultrathin Polar Crystal Films. ACS Photonics 6 (6), 1365–1371 (2019).
Zeitschriftenartikel
, , , , , , B. Roldan Cuenya und : Bio-inspired design: bulk iron–nickel sulfide allows for efficient solvent-dependent CO2 reduction. Chemical Science 10 (4), 1075–1081 (2019).
Zeitschriftenartikel
, und K. Reuter: Kinetics-Based Computational Catalyst Design Strategy for the Oxygen Evolution Reaction on Transition-Metal Oxide Surfaces. Journal of Physical Chemistry C 123 (13), 8287–8303 (2019).
Zeitschriftenartikel
Plodinec, M., , M.G. Willinger, A. Hammud, X. Huang, und : Black TiO2 nanotube arrays decorated with Ag nanoparticles for enhanced visible-light photocatalytic oxidation of salicylic acid. Journal of Alloys and Compounds 776, 883–896 (2019).
Zeitschriftenartikel
Pohl, M.N., , , H. Ali, , , B. Winter und : Do water's electrons care about electrolytes? Chemical Science 10 (3), 848–865 (2019).
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, , S. Eibenberger, und : High sensitivity microwave spectroscopy in a cryogenic buffer gas cell. Review of Scientific Instruments 90 (5), 053104 (2019).
Zeitschriftenartikel
, , X. Huang, , , , A. Trunschke, und : From a Molecular Single-Source Precursor to a Selective High- Performance RhMnOx Catalyst for the Conversion of Syngas to Ethanol. ChemCatChem 11 (2), 885–892 (2019).
Zeitschriftenartikel
Prieto, M., T. Schmidt, S.K. Shaikhutdinov und H.-J. Freund: Chemische Reaktionen in eingegrenzten Räumen. Jahrbuch / Max-Planck-Gesellschaft 11659628 (2019).