Publications of the MPI für Kohlenforschung

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 2015, 373, 20150005.

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 2015, 44, 20785–20807.

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 2015, 17, 31978–31987.

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 2015, 54, 12002–12018.

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 2015, 54, 15750–15755.

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 2015, 16, 30133–30143.

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 2015, 54, 15452–15456.

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 2015, 454, 2292–2298.

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 2015, 11, 5758–5781.

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 2015, 17, 5850–5853.

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 2015, 5, 5168–5173.

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

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 2015, 87, 1686–1695.

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 2015, 1847, 1509–1517.

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 2015, 5, 528–536.

Poliakoff, M.; Leitner, W.; Streng, E. S. The Twelve Principles of CO₂ CHEMISTRY. Faraday Discussions 2015, 183, 9–17.

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 2015, 798, 146–151.

Wang, J.; Reetz, M. T. Biocatalysis: Chiral Cascades. Nature Chemistry 2015, 7, 948–949.

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 2015, 137, 14733–14742.

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 2015, 137, 14733–14742.