Zeitschriftenartikel (278)
2017
Zeitschriftenartikel
B. Winter, J. Velasco Vélez und : Introducing Ionic-Current Detection for X-ray Absorption Spectroscopy in Liquid Cells. The Journal of Physical Chemistry Letters 8 (9), 2087–2092 (2017).
, , , ,
Zeitschriftenartikel
H. Klemm, , T. Schmidt, und : Mechanism and Kinetics of Hematite Crystallization in Air: Linking Bulk and Surface Models via Mesoporous Films with Defined Nanostructure. Chemistry of Materials 29 (4), 1724–1734 (2017).
, ,
Zeitschriftenartikel
Schumann, J., J. Kröhnert, E. Frei, R. Schlögl und A. Trunschke: IR-Spectroscopic Study on the Interface of Cu-Based Methanol Synthesis Catalysts: Evidence for the Formation of a ZnO Overlayer. Topics in Catalysis 60 (19-20), 1735–1743 (2017).
Zeitschriftenartikel
A. Tkatchenko: Quantum-chemical insights from deep tensor neural networks. Nature Communications 8, 13890 (2017).
, , , und
Zeitschriftenartikel
Seifert, T., , M. Sajadi, , , M. Wolf, und T. Kampfrath: Ultrabroadband single-cycle terahertz pulses with peak fields of 300 kV cm-1 from a metallic spintronic emitter. Applied Physics Letters 110 (25), 252402 (2017).
Zeitschriftenartikel
Seifert, T., , , , , , , , , , , , , , , , , M. Wolf, , , , und T. Kampfrath: Terahertz Spin Currents and Inverse Spin Hall Effect in Thin-Film Heterostructures Containing Complex Magnetic Compounds. SPIN 7 (3), 1740010 (2017).
Zeitschriftenartikel
Seo, J., W. Hoffmann, S. Warnke, X. Huang, S. Gewinner, W. Schöllkopf, , G.von Helden und K. Pagel: An infrared spectroscopy approach to follow β-sheet formation in peptide amyloid assemblies. Nature Chemistry 9 (1), 39–44 (2017).
Zeitschriftenartikel
Seo, J., S. Warnke, K. Pagel, und G.von Helden: Infrared spectrum and structure of the homochiral serine octamer-dichloride complex. Nature Chemistry 9, 1263–1268 (2017).
Zeitschriftenartikel
L.M. Ghiringhelli und : Levy-Lieb-Based Monte Carlo Study of the Dimensionality Behaviour of the Electronic Kinetic Functional. Computation 5 (2), 30 (2017).
,
Zeitschriftenartikel
Shang, H., C. Carbogno, P. Rinke und M. Scheffler: Lattice dynamics calculations based on density-functional perturbation theory in real space. Computer Physics Communications 215, 26–46 (2017).
Zeitschriftenartikel
J. Hoja, , , , , A. Tkatchenko, , , und : Powder diffraction and crystal structure prediction identify four new coumarin polymorphs. Chemical Science 8 (7), 4926–4940 (2017).
, , , ,
Zeitschriftenartikel
Simoes Brambila, D., , , und : Role of electronic correlations in photoionization of NO2 in the vicinity of the 2A1/2B2 conical intersection. Physical Chemistry Chemical Physics 19 (30), 19673–19682 (2017).
Zeitschriftenartikel
S. Alarcón Villaseca, H. Shang, S.V. Levchenko, , , , M. Scheffler, , , und : Li/MgO Catalysts Doped with Alio-valent Ions. Part II: Local Topology Unraveled by EPR/NMR and DFT Modeling. ChemCatChem 9 (18), 3597–3610 (2017).
,
Zeitschriftenartikel
K. Reuter und : Efficient Implicit Solvation Method for Full Potential DFT. Journal of Chemical Theory and Computation 13 (11), 5582–5603 (2017).
, , , ,
Zeitschriftenartikel
Y. Cui, X. Weng, J. Seifert, S. Schauermann, , S.K. Shaikhutdinov und H.-J. Freund: Initial stages of CO2 adsorption on CaO: a combined experimental and computational study. Physical Chemistry Chemical Physics 19 (6), 4231–4242 (2017).
,
Zeitschriftenartikel
S.K. Shaikhutdinov und H.-J. Freund: Oxygen Scrambling of CO2 Adsorbed on CaO(001). The Journal of Physical Chemistry C 121, 18625–18634 (2017).
, ,
Zeitschriftenartikel
Song, X., M.R. Fagiani, S. Debnath, , , , S. Gewinner, W. Schöllkopf, und : Excess charge driven dissociative hydrogen adsorption on Ti2O4−. Physical Chemistry Chemical Physics 19 (17), 23154–23161 (2017).
Zeitschriftenartikel
Song, X., M.R. Fagiani, S. Gewinner, W. Schöllkopf, , , und : Gas-Phase Vibrational Spectroscopy of the Aluminum Oxide Anions (Al2O3)1-6AlO2-. ChemPhysChem 18 (8), 868–872 (2017).
Zeitschriftenartikel
Song, X., M.R. Fagiani, S. Gewinner, W. Schöllkopf, , , und : Inside Cover: Gas-Phase Vibrational Spectroscopy of the Aluminum Oxide Anions (Al2O3)1-6AlO2-. ChemPhysChem 18 (8), 866–866 (2017).
Zeitschriftenartikel
Stähler, J. und : Global and local aspects of the surface potential landscape for energy level alignment at organic-ZnO interfaces. Chemical Physics 485-486, 149–165 (2017).
Zeitschriftenartikel
L. Rettig, , Y.W. Windsor, , , , , , , , und : Interplay of Fe and Tm moments through the spin-reorientation transition in TmFe O3. Physical Review B 96 (17), 174408 (2017).
,
Zeitschriftenartikel
K. Reuter und : Li+ Defects in a Solid-State Li Ion Battery: Theoretical Insights with a Li3OCl Electrolyte. Chemistry of Materials 29 (10), 4330–4340 (2017).
, ,
Zeitschriftenartikel
R. Schlögl: Carbocatalysis in Liquid-Phase Reactions. Angewandte Chemie International Edition 56 (4), 936–964 (2017).
, , , und
Zeitschriftenartikel
, , , und
Zeitschriftenartikel
X. Huang, , G. Algara-Siller, , , , und : Self-assembled carbon nitride for photocatalytic hydrogen evolution and degradation of p-nitrophenol. Applied Catalysis B 205, 1–10 (2017).
, , ,
Zeitschriftenartikel
Supady, A., und C. Baldauf: About Underappreciated Yet Active Conformations of Thiourea Organocatalysts. Organic Letters 19 (16), 4199–4202 (2017).
Zeitschriftenartikel
Sutton, C.A., , und : Singlet Fission in Rubrene Derivatives: Impact of Molecular Packing. Chemistry of Materials 29 (7), 2777–2787 (2017).
Zeitschriftenartikel
F. Girgsdies, , X. Huang, und : Synthesis of cobalt ferrite nanoparticles by constant pH co-precipitation and their high catalytic activity in CO oxidation. New Journal of Chemistry 41 (15), 7356–7363 (2017).
, ,
Zeitschriftenartikel
H. Marchetto, , , , , , , , , , , , , , , , , , , , , T. Schmidt, , , , , und : The EIGER detector for low-energy electron microscopy and photoemission electron microscopy. Journal of Synchrotron Radiation 24 (5), 963–974 (2017).
,
Zeitschriftenartikel
Tong, Y., F. Lapointe, M. Thämer, M. Wolf und R.K. Campen: Hydrophobic Water Probed Experimentally at the Gold Electrode/Aqueous Interface. Angewandte Chemie International Edition 56 (15), 4211–4214 (2017).
Zeitschriftenartikel
Tong, Y., F. Lapointe, M. Thämer, M. Wolf und R.K. Campen: Hydrophobic Water Probed Experimentally at the Gold Electrode/Aqueous Interface. Angewandte Chemie 129 (15), 4279–4278 (2017).
Zeitschriftenartikel
Tong, Y., F. Lapointe, M. Thämer, M. Wolf und R.K. Campen: Inside Cover: Hydrophobic Water Probed Experimentally at the Gold Electrode/Aqueous Interface. Angewandte Chemie International Edition 56 (15), 4068–4068 (2017).
Zeitschriftenartikel
Tong, Y., F. Lapointe, M. Thämer, M. Wolf und R.K. Campen: Innentitelbild: Hydrophobic Water Probed Experimentally at the Gold Electrode/Aqueous Interface. Angewandte Chemie 129 (15), 4128–4128 (2017).
Zeitschriftenartikel
C. Draxl: Predicting Ground-State Configurations and Electronic Properties of the Thermoelectric Clathrates Ba8AlxSi46–x and Sr8AlxSi46–x. Chemistry of Materials 29 (6), 2414–2424 (2017).
, und
Zeitschriftenartikel
Trunschke, A., J. Noack, , F. Girgsdies, T. Lunkenbein, V. Pfeifer, M. Hävecker, P. Kube, C. Sprung, und R. Schlögl: The Impact of the Bulk Structure on Surface Dynamics of Complex Mo–V-based Oxide Catalysts. ACS Catalysis 7 (4), 3061–3071 (2017).
Zeitschriftenartikel
S. Gewinner, W. Schöllkopf, und : Infrared Spectroscopy and Structures of Boron-Doped Silicon Clusters (SinBm, n = 3–8, m = 1–2). The Journal of Physical Chemistry C 121 (17), 9560–9571 (2017).
, ,
Zeitschriftenartikel
M.G. Willinger, und : Effect of lattice mismatch on the magnetic properties of nanometer-thick La0.9Ba0.1MnO3(LBM) films and LBM/BaTiO3/LBM heterostructures. Applied Surface Science 425, 988–995 (2017).
, ,
Zeitschriftenartikel
S. Gewinner, W. Schöllkopf, , A. Fielicke und : Hydrogen Chemisorption on Singly Vanadium-Doped Aluminum Clusters. Chemistry – A European Journal 23 (62), 15638–15643 (2017).
, , ,
Zeitschriftenartikel
Velasco Vélez, J., M. Hävecker, A. Knop-Gericke, , , , , , , , , , , , und : Multiscale Photo-Based In-Situ and Operando Spectroscopies in Time and Energy Landscapes. Synchrotron Radiation News 30 (2), 14–19 (2017).
Zeitschriftenartikel
Velasco Vélez, J., T. Jones, V. Pfeifer, , , , , , und R. Schlögl: Trends in reactivity of electrodeposited 3d transition metals on gold revealed by operando soft x-ray absorption spectroscopy during water splitting. Journal of Physics D 50 (2), 024002 (2017).
Zeitschriftenartikel
J. Hermann, A. Tkatchenko und : Unifying Microscopic and Continuum Treatments of van der Waals and Casimir Interactions. Physical Review Letters 118 (26), 266802 (2017).
,
Zeitschriftenartikel
R. Schlögl: 50 Years of German Catalysis Meetings: From Twin Roots to a Joint Success Story. ChemCatChem 9 (2), 527–532 (2017).
und
Zeitschriftenartikel
Waldecker, L., R. Bertoni, , , T. Vasileiadis, D. Zahn, und R. Ernstorfer: Momentum-Resolved View of Electron-Phonon Coupling in Multilayer WSe2. Physical Review Letters 119 (3), 036803 (2017).
Zeitschriftenartikel
Waldecker, L., T. Vasileiadis, R. Bertoni, R. Ernstorfer, , , und : Coherent and incoherent structural dynamics in laser-excited antimony. Physical Review B 95 (5), 054302 (2017).
Zeitschriftenartikel
D.S. Su: Determination of the acidic properties of carboxylated carbocatalysts in an acid-catalyzed ring-opening reaction using kinetic profiling. Nano Research 10 (9), 2954–2965 (2017).
, und
Zeitschriftenartikel
D. Teschner, X. Huang, , M.G. Willinger, und R. Schlögl: Nanosized palladium on holey graphene sheets incorporating PxOy for effective formic acid oxidation. Electrochemistry Communications 74, 24–27 (2017).
,
Zeitschriftenartikel
D. Teschner, , X. Huang, M.G. Willinger, und R. Schlögl: Fabrication of nanoscale NiO/Ni heterostructures as electrocatalysts for efficient methanol oxidation. Journal of Materials Chemistry A 5 (20), 9946–9951 (2017).
,
Zeitschriftenartikel
X. Huang, M.G. Willinger und : Ni/NiO nanoparticles on a phosphorous oxide/graphene hybrid for efficient electrocatalytic water splitting. Journal of Materials Chemistry A 5 (28), 14758–14762 (2017).
, , ,