Zeitschriftenartikel (267)
2015
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Eichelbaum, M., M. Hävecker, C. Heine, A.M. Wernbacher, , A. Trunschke und R. Schlögl: Der elektronische Faktor in der Alkanoxidationskatalyse. Angewandte Chemie 127 (10), 2965–2969 (2015).
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H. Haak, , und : A new Stark decelerator based surface scattering instrument for studying energy transfer at the gas-surface interface. Review of Scientific Instruments 86 (4), 043306 (2015).
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Ernstorfer, R.: Im Fokus ultrakurzer Laser: das Wechselspiel von Elektronen und Kristallstruktur. Jahrbuch / Max-Planck-Gesellschaft 9016928 (2015).
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M. Eiswirth, , , und : Detection of Hopf bifurcations in chemical reaction networks using convex coordinates. Journal of Computational Physics 291, 279–302 (2015).
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Ertl, G.: Walther Nernst und die Entwicklung der Physikalischen Chemie. Angewandte Chemie 127 (20), 5922–5930 (2015).
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Ertl, G. und H.-J. Freund: John T. Yates, Jr. 1935–2015: Pioneer of Modern Surface Science. Angewandte Chemie International Edition 54 (48), 14225–14225 (2015).
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Ertl, G. und H.-J. Freund: John T. Yates, Jr. (1935–2015): Pionier der modernen Oberflächenforschung. Angewandte Chemie 127 (48), 14431–14431 (2015).
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Fagiani, M.R., , T. Esser, , , und : Opening of an icosahedral boron framework: A combined infrared spectroscopic and computational study. Chemical Physics Letters 625, 48–52 (2015).
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A. Klyushin, A. Knop-Gericke, R. Schlögl und : Evidence for the Bifunctional Nature of Pt–Re Catalysts for Selective Glycerol Hydrogenolysis. ACS Catalysis 5 (10), 5679–5695 (2015).
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Feiten, F.E., H. Kuhlenbeck und H.-J. Freund: Surface Structure of V2O3(0001) – A Combined I/V-LEED + STM Study. The Journal of Physical Chemistry C 119 (40), 22961–22969 (2015).
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Feiten, F.E., J. Seifert, , H. Kuhlenbeck, , und H.-J. Freund: Surface Structure of V2O3(0001) Revisited. Physical Review Letters 114 (21), 216101 (2015).
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F. Calaza, M. Sterrer und H.-J. Freund: Cooperative Chemisorption-Induced Physisorption of CO2 Molecules by Metal–Organic Chains. ACS Nano 9 (12), 12124–12136 (2015).
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M.G. Willinger, , und : Gold-dotted hydroxyapatite nanoparticles as multifunctional platforms for medical applications. RSC Advances 5 (85), 69184–69195 (2015).
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Ferri, N., , A. Ambrosetti, und A. Tkatchenko: Electronic Properties of Molecules and Surfaces with a Self-Consistent Interatomic van der Waals Density Functional. Physical Review Letters 114 (17), 176802 (2015).
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I. Kasatkin, J. Schumann, M. Behrens, R. Schlögl und : Kinetics of deactivation on Cu/ZnO/Al2O3 methanol synthesis catalysts. Applied Catalysis A 502, 262–270 (2015).
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X. Yu, J.A. Boscoboinik, S.K. Shaikhutdinov und H.-J. Freund: Ultrathin Ti-Silicate Film on a Ru(0001) Surface. The Journal of Physical Chemistry C 119 (27), 15443–15448 (2015).
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Freund, H.-J. und : The Frontiers of Catalysis Science and Future Challenges. Catalysis Letters 145 (1), 1–2 (2015).
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Friedrich, B.: Fritz Haber und der „Krieg der Chemiker“: Leben und Werk eines umstrittenen Wissenschaftlers. Physik in unserer Zeit 46 (3), 118–125 (2015).
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R. Blume und : Enhancement of Stability and Activity of MnOx/Au Electrocatalysts for Oxygen Evolution through Adequate Electrolyte Composition. ACS Catalysis 5 (12), 7265–7275 (2015).
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Gao, W. und A. Tkatchenko: Sliding Mechanisms in Multilayered Hexagonal Boron Nitride and Graphene: The Effects of Directionality, Thickness, and Sliding Constraints. Physical Review Letters 114 (09), 096101 (2015).
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K. Reuter: Ab initio prediction of the equilibrium shape of supported Ag nanoparticles on α-Al2O3(0 0 0 1). Journal of Catalysis 321, 1–6 (2015).
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Ghiringhelli, L.M. und S.V. Levchenko: Strengthening gold-gold bonds by complexing gold clusters with noble gases. Inorganic Chemistry Communications 55, 153–156 (2015).
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Ghiringhelli, L.M., , S.V. Levchenko, und M. Scheffler: Big Data of Materials science: Critical Role of the Descriptor. Physical Review Letters 114 (10), 105503 (2015).
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Gonchar, A., J.-C. Lian, T. Risse, H.-J. Freund, und : Characterization of O--Centers on Single Crystalline MgO(001)-Films. Topics in Catalysis 58 (12-13), 811–823 (2015).
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Gonzalez Florez, A.I., D.-S. Ahn, S. Gewinner, W. Schöllkopf und G.von Helden: IR spectroscopy of protonated leu-enkephalin and its 18-crown-6 complex embedded in helium droplets. Physical Chemistry Chemical Physics 17 (34), 21902–21911 (2015).
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Greiner, M., T. Jones, B. Johnson, T. Rocha, Z.-J. Wang, , M.G. Willinger, A. Knop-Gericke und R. Schlögl: The oxidation of copper catalysts during ethylene epoxidation. Physical Chemistry Chemical Physics 17 (38), 25073–25089 (2015).
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B. Roldan Cuenya, , , , , , , , , und : Element-Resolved Thermodynamics of Magnetocaloric LaFe13−xSix. Physical Review Letters 114 (5), 057202 (2015).
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Hansen, K., , , , , und A. Tkatchenko: Machine Learning Predictions of Molecular Properties: Accurate Many-Body Potentials and Nonlocality in Chemical Space. The Journal of Physical Chemistry Letters 6 (11), 2326–2331 (2015).
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Heine, C., M. Hävecker, A. Trunschke, R. Schlögl und M. Eichelbaum: The impact of steam on the electronic structure of the selective propane oxidation catalyst MoVTeNb oxide (orthorhombic M1 phase). Physical Chemistry Chemical Physics 17 (14), 8983–8993 (2015).
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Heine, N. und K.R. Asmis: Cryogenic ion trap vibrational spectroscopy of hydrogen-bonded clusters relevant to atmospheric chemistry. International Reviews in Physical Chemistry 34 (1), 1–34 (2015).
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Heine, N., M.R. Fagiani und : Disentangling the Contribution of Multiple Isomers to the Infrared Spectrum of the Protonated Water Heptamer. The Journal of Physical Chemistry Letters 6 (12), 2298–2304 (2015).
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A. Rubio, M. Scheffler und P. Rinke: Static correlation and electron localization in molecular dimers from the self-consistent RPA and GW approximation. Physical Review B 91 (16), 165110 (2015).
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M. Scheffler und K. Reuter: Multi-lattice Kinetic Monte Carlo Simulations from First Principles: Reduction of the Pd(100) Surface Oxide by CO. ACS Catalysis 5 (2), 1199–1209 (2015).
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Hofmann, J., , und K. Pagel: Identification of carbohydrate anomers using ion mobility–mass spectrometry. Nature 526 (7572), 241–244 (2015).
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Hofmann, O.T., P. Rinke, M. Scheffler und : Integer versus Fractional Charge Transfer at Metal(/Insulator)/Organic Interfaces: Cu(/NaCl)/TCNE. ACS Nano 9 (5), 5391–5404 (2015).
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C. Baldauf und : The von Willebrand factor A2 domain disulfide bond exists in oxidized and reduced states in the circulation and regulates function. Journal of Thrombosis and Haemostasis 13 (S2), PO669-TUE (2015).
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M.E. Schuster, , , , , , D.S. Su und : The Active Sites of a Rod-Shaped Hollandite DeNOx Catalyst. Chemistry – A European Journal 21 (27), 5619–5623 (2015).
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Huang, X., Z.-J. Wang, G. Weinberg, und M.G. Willinger: In Situ Scanning Electron Microscopy Observation of Growth Kinetics and Catalyst Splitting in Vapor–Liquid–Solid Growth of Nanowires. Advanced Functional Materials 25 (37), 5979–5987 (2015).
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Huang, X., , , , , M.G. Willinger, , , und : Ultraviolet photodetectors with high photosensitivity based on type-II ZnS/SnO2 core/shell heterostructured ribbons. Nanoscale 7 (12), 5311–5319 (2015).
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Ihrig, A., J. Wieferink, I.Y. Zhang, M. Ropo, X. Ren, P. Rinke, M. Scheffler und V. Blum: Accurate localized resolution of identity approach for linear-scaling hybrid density functionals and for many-body perturbation theory. New Journal of Physics 17 (9), 093020 (2015).
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A. Knop-Gericke, , und : Probing Operating Electrochemical Interfaces by Photons and Neutrons. ChemElectroChem 2 (10), 1427–1445 (2015).
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A. Saywell, , , und : Physisorption Controls the Conformation and Density of States of an Adsorbed Porphyrin. The Journal of Physical Chemistry C 119 (50), 27982–27994 (2015).
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J. Lee: Electrocatalytic Oxidation of Formic Acid: Closing the Gap Between Fundamental Study and Technical Applications. Electrocatalysis 6 (1), 20–32 (2015).
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Y. Deng: Control of electron localization in the dissociation of H2+ and its isotopes with a THz pulse. Chinese Physics B 24 (1), 013204 (2015).
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T. Kampfrath, , und : Accessing the fundamentals of magnetotransport in metals with terahertz probes. Nature Physics 11 (9), 761–766 (2015).
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Jones, T., T. Rocha, A. Knop-Gericke, , R. Schlögl und : Thermodynamic and spectroscopic properties of oxygen on silver under an oxygen atmosphere. Physical Chemistry Chemical Physics 17 (14), 9288–9312 (2015).
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Jones, T., T. Rocha, A. Knop-Gericke, , R. Schlögl und : Insights into the electronic structure of the oxygen species active in alkene epoxidation on silver. ACS Catalysis 5 (10), 5846–5850 (2015).