Wissenschaftliche Publikationen

Abel, M.; Marx, S.; Meijer, G.; Santambrogio, G.: Vibrationally exciting molecules trapped on a microchip. Molecular Physics 110 (15-16), S. 1829 - 1837 (2012)

Allen, J. W.; Goldsmith, C. F.; Green, W. H.: Automatic estimation of pressure-dependent rate coefficients. Physical Chemistry Chemical Physics 14 (3), S. 1131 - 1155 (2012)

Amakawa, K.; Wrabetz, S.; Kröhnert, J.; Tzolova-Müller, G.; Schlögl, R.; Trunschke, A.: In Situ Generation of Active Sites in Olefin Metathesis. Journal of the American Chemical Society 134 (28), S. 11462 - 11473 (2012)

Amrute, A. P.; Mondelli, C.; Moser, M.; Novell-Leruth, G.; López, N.; Rosenthal, D.; Farra, R.; Schuster, M. E.; Teschner, D.; Schmidt, T. et al.; Pérez-Ramírez, J.: Performance, structure, and mechanism of CeO₂ in HCl oxidation to Cl₂. Journal of Catalysis 286, S. 287 - 297 (2012)

Andrade, X.; Alberdi-Rodriguez, J.; Strubbe, D. A.; Oliveira, M. J. T.; Nogueira, F.; Castro, A.; Muguerza, J.; Arruabarrena, A.; Louie, S. G.; Aspuru-Guzik, A. et al.; Rubio, A.; Marques, M. A.L.: Time-dependent density-functional theory in massively parallel computer architectures: the OCTOPUS project. Journal of Physics: Condensed Matter 24 (23), 233202 (2012)

Arendt, P.: Nearly Unattenuated Charge Density Wave Transport in a Linear Chain Conductor Fabricated by Spark Discharge. Zeitschrift für Naturforschung Section A 67, S. 29 - 38 (2012)

Arion, T.; Püttner, R.; Lupulescu, C.; Ovsyannikov, R.; Förstel, M.; Öhrwall, G.; Lindblad, A.; Ueda, K.; Svensson, S.; Bradshaw, A. M. et al.; Eberhardt, W.; Hergenhahn, U.: New insight into the Auger decay process in O₂: The coincidence perspective. Journal of Electron Spectroscopy and Related Phenomena 185 (8-9), S. 234 - 243 (2012)

Armbrüster, M.; Behrens, M.; Cinquini, F.; Föttinger, K.; Grin, Y.; Haghofer, A.; Klötzer, B.; Knop-Gericke, A.; Lorenz, H.; Ota, A. et al.; Penner, S.; Prinz, J.; Rameshan, C.; Révay, Z.; Rosenthal, D.; Rupprechter, G.; Sautet, P.; Schlögl, R.; Shao, L.; Szentmiklósi, L.; Teschner, D.; Torres, D.; Wagner, R.; Widmer, R.; Wowsnick, G.: How to Control the Selectivity of Palladium-based Catalysts in Hydrogenation Reactions: The Role of Subsurface Chemistry. ChemCatChem 4 (8), S. 1048 - 1063 (2012)

Armbrüster, M.; Kovnir, K.; Friedrich, M.; Teschner, D.; Wowsnick, G.; Hahne, M.; Gille, P.; Szentmiklósi, L.; Feuerbacher, M.; Heggen, M. et al.; Girgsdies, F.; Rosenthal, D.; Schlögl, R.; Grin, Y.: Al₁₃Fe₄ as a low-cost alternative for palladium in heterogeneous hydrogenation. Nature Materials 11 (8), S. 690 - 693 (2012)

Arrigo, R.; Schuster, M. E.; Wrabetz, S.; Girgsdies, F.; Tessonnier, J.-P.; Centi, G.; Perathoner, S.; Su, D. S.; Schlögl, R.: New Insights from Microcalorimetry on the FeO_x/CNT-Based Electrocatalysts Active in the Conversion of CO₂ to Fuels. ChemSusChem: chemistry & sustainability, energy & materials 5 (3), S. 577 - 586 (2012)

Arrigo, R.; Wrabetz, S.; Schuster, M. E.; Wang, D.; Villa, A.; Rosenthal, D.; Girgsdies, F.; Weinberg, G.; Prati, L.; Schlögl, R. et al.; Su, D. S.: Tailoring the morphology of Pd nanoparticles on CNTs by nitrogen and oxygen functionalization. Physical Chemistry Chemical Physics 14 (30), S. 10523 - 10532 (2012)

Asmis, K. R.: Structure Characterization of Metal Oxide Clusters by Vibrational Spectroscopy: Possibilities and Prospects. Physical Chemistry Chemical Physics 14 (26), S. 9270 - 9281 (2012)

Asmis, K. R.; Neumark, D. M.: Vibrational Spectroscopy of Microhydrated Conjugate Base Anions. Accounts of Chemical Research 45 (1), S. 43 - 52 (2012)

Asmis, K. R.; Wende, T.; Brümmer, M.; Gause, O.; Santambrogio, G.; Stanca-Kaposta, E. C.; Döbler, J.; Niedziela, A.; Sauer, J.: Structural variability in transition metal oxide clusters: gas phase vibrational spectroscopy of V₃O_6-8⁺. Physical Chemistry Chemical Physics 14 (26), S. 9377 - 9388 (2012)

Bagus, P. S.; Wieckowski, A.; Freund, H.-J.: The contribution of lattice strain to core-level binding energy shifts in metal nanoparticles: Generality and origin of the shifts. Computational and theoretical chemistry 987, S. 22 - 24 (2012)

Baldauf, C.; Hofmann, H.-J.: Ab initio MO Theory – An Important Tool in Foldamer Research: Prediction of Helices in Oligomers of omega-Amino Acids. Helvetica Chimica Acta 95 (12), S. 2348 - 2383 (2012)

Baltenkov, A. S.; Becker, U.; Manson, S. T.; Msezane, A. Z.: Interference in the molecular photoionization and Young's double-slit experiment. Journal of Physics B: Atomic, Molecular and Optical Physics 45 (3), 035202 (2012)

Bauer, M.; Schoch, R.; Shao, L.; Zhang, B. S.; Knop-Gericke, A.; Willinger, M. G.; Schlögl, R.; Teschner, D.: Structure–Activity Studies on Highly Active Palladium Hydrogenation Catalysts by X-ray Absorption Spectroscopy. Journal of Physical Chemistry C 116 (42), S. 22375 - 22385 (2012)

Bayer, B.; Fouquet, M.; Blume, R.; Wirth, C. T.; Weatherup, R.; Ogata, K.; Knop-Gericke, A.; Schlögl, R.; Hofmann, S.; Robertson, J.: Co-Catalytic Solid-State Reduction Applied to Carbon Nanotube Growth. The Journal of Physical Chemistry C 116 (1), S. 1107 - 1113 (2012)

Beck, B.; Harth, M.; Hamilton, N.; Carrero, C.; Uhlrich, J.; Trunschke, A.; Shaikhutdinov, S. K.; Schubert, H.; Freund, H.-J.; Schlögl, R. et al.; Sauer, J.; Schomäcker, R.: Partial oxidation of ethanol on vanadia catalysts on supporting oxides with different redox properties compared to propane. Journal of Catalysis 296, S. 120 - 131 (2012)