Scientific Publications

Franció, G.; Hintermair, U.; Leitner, W.: Unlocking the potential of supported liquid phase catalysts with supercritical fluids: low temperature continuous flow catalysis with integrated product separation. Philosophical Transactions of the Royal Society of London - Series A: Mathematical Physical and Engineering Sciences 373 (2057), p. 20150005 (2015)

Roşca, D.-A.; Wright, J. A.; Bochmann, M.: An element through the looking glass: exploring the Au–C, Au–H and Au–O energy landscape. Dalton Transactions 44 (48), pp. 20785 - 20807 (2015)

Buchner, F.; Heggen, B.; Ritze, H.-H.; Thiel, W.; Lübcke, A.: Excited-state dynamics of guanosine in aqueous solution revealed by time-resolved photoelectron spectroscopy: experiment and theory. Physical Chemistry Chemical Physics 17 (47), pp. 31978 - 31987 (2015)

England, J.; Bill, E.; Weyhermüller, T.; Neese, F.; Atanasov, M.; Wieghardt, K.: Molecular and Electronic Structures of Homoleptic Six-Coordinate Cobalt(I) Complexes of 2,2′:6′,2″-Terpyridine, 2,2′-Bipyridine, and 1,10-Phenanthroline. An Experimental and Computational Study. Inorganic Chemistry 54 (24), pp. 12002 - 12018 (2015)

Luska, K. L.; Migowski, P.; El Sayed, S.; Leitner, W.: Synergistic Interaction within Bifunctional Ruthenium Nanoparticle/SILP Catalysts for the Selective Hydrodeoxygenation of Phenols. Angewandte Chemie International Edition 54 (52), pp. 15750 - 15755 (2015)

Wang, X.; Schrader, W.: Selective Analysis of Sulfur-Containing Species in a Heavy Crude Oil by Deuterium Labeling Reactions and Ultrahigh Resolution Mass Spectrometry. International Journal of Molecular Sciences 16 (12), pp. 30133 - 30143 (2015)

Werlé, C.; Goddard, R.; Fürstner, A.: The First Crystal Structure of a Reactive Dirhodium Carbene Complex and a Versatile Method for the Preparation of Gold Carbenes by Rhodium-to-Gold Transmetalation. Angewandte Chemie International Edition 54 (51), pp. 15452 - 15456 (2015)

Owens, A.; Yurchenko, S. N.; Polyansky, O. L.; Ovsyannikov, R. I.; Thiel, W.; Špirko, V.: Accurate prediction of H₃O⁺ and D₃O⁺ sensitivity coefficients to probe a variable proton-to-electron mass ratio. Monthly Notices of the Royal Astronomical Society 454 (3), pp. 2292 - 2298 (2015)

Tuna, D.; Lefrancois, D.; Wolański, Ł.; Gozem, S.; Schapiro, I.; Andruniów, T.; Dreuw, A.; Olivucci, M.: Assessment of Approximate Coupled-Cluster and Algebraic-Diagrammatic-Construction Methods for Ground- and Excited-State Reaction Paths and the Conical-Intersection Seam of a Retinal-Chromophore Model. Journal of Chemical Theory and Computation 11 (12), pp. 5758 - 5781 (2015)

Ganß, A.; Belda, R.; Pitarch, J.; Goddard, R.; Garcia-Espana, E.; Kubik, S.: Synthesis and Structural Characterization of a Cyclen-Derived Molecular Cage. Organic Letters 17 (23), pp. 5850 - 5853 (2015)

Al Shaal, M. G.; Ciptonugroho, W.; Holzhauser, F. J.; Mensah, J. B.; Hausoul, P. J. C.; Palkovits, R.: Catalytic upgrading of α-angelica lactone to levulinic acid esters under mild conditions over heterogeneous catalysts. Catalysis Science & Technology 5 (12), pp. 5168 - 5173 (2015)

Deng, X.; Dodekatos, G.; Pupovac, K.; Weidenthaler, C.; Schmidt, W.; Schüth, F.; Tüysüz, H.: Pseudomorphic Generation of Supported Catalysts for Glycerol Oxidation. ChemCatChem 7 (23), pp. 3832 - 3837 (2015)

Dominguez de Maria, P.; Grande, P. M.; Leitner, W.: Current Trends in Pretreatment and Fractionation of Lignocellulose as Reflected in Industrial Patent Activities. Chemie-Ingenieur-Technik 87 (12), pp. 1686 - 1695 (2015)

Götze, J. P.; Karasulu, B.; Patil, M.; Thiel, W.: Vibrational relaxation as the driving force for wavelength conversion in the peridinin-​chlorophyll a-​protein. Biochimica et Biophysica Acta, Bioenergetics 1847 (12), pp. 1509 - 1517 (2015)

Klopries, S.; Bravo-Rodriguez, K.; Koopmans, K. R. M.; Sundermann, U.; Yahiaoui, S.; Arens, J.; Kushnir, S.; Sanchez Garcia, E.; Schulz, F.: Data in support of substrate flexibility of a mutated acyltransferase domain and implications for polyketide biosynthesis. Data in Brief 5, pp. 528 - 536 (2015)

Poliakoff, M.; Leitner, W.; Streng, E. S.: The Twelve Principles of CO₂ CHEMISTRY. Faraday Discussions 183, pp. 9 - 17 (2015)

Wadepohl, H.; Krüger, C.; Siebert, W.: Structures and bonding of homoleptic bis(2,3-dihydro-1,3-diborole) complexes of nickel and platinum. Journal of Organometallic Chemistry 798 (1), pp. 146 - 151 (2015)

Wang, J.; Reetz, M. T.: Biocatalysis: Chiral cascades. Nature Chemistry 7 (12), pp. 948 - 949 (2015)

Lonsdale, R.; Reetz, M. T.: Reduction of α,β-Unsaturated Ketones by Old Yellow Enzymes: Mechanistic Insights from Quantum Mechanics/Molecular Mechanics Calculations. Journal of the American Chemical Society 137 (46), pp. 14733 - 14742 (2015)

Lonsdale, R.; Reetz, M. T.: Reduction of α,β-Unsaturated Ketones by Old Yellow Enzymes: Mechanistic Insights from Quantum Mechanics/Molecular Mechanics Calculations. Journal of the American Chemical Society 137 (46), pp. 14733 - 14742 (2015)