Zeitschriftenartikel (217)
2016
Zeitschriftenartikel
Bistoni, G.; ; Advances in Charge Displacement Analysis. Journal of Chemical Theory and Computation 2016, 12, 1236–1244.
Zeitschriftenartikel
Dral, P. O.; Wu, X.; Spörkel, L.; Koslowski, A.; Thiel, W. Semiempirical Quantum-Chemical Orthogonalization-Corrected Methods: Benchmarks for Ground-State Properties. Journal of Chemical Theory and Computation 2016, 12, 1097–1120.
Zeitschriftenartikel
Dral, P. O.; Wu, X.; Spörkel, L.; Koslowski, A.; ; ; ; Thiel, W. Semiempirical Quantum-Chemical Orthogonalization-Corrected Methods: Theory, Implementation, and Parameters. Journal of Chemical Theory and Computation 2016, 12, 1082–1096.
Zeitschriftenartikel
Guo, Y.; Sivalingam, K.; ; Neese, F. SparseMaps—A systematic infrastructure for reduced-scaling electronic structure methods. III. Linear-scaling multireference domain-based pair natural orbital N-electron valence perturbation theory. The Journal of Chemical Physics 2016, 144, 094111.
Zeitschriftenartikel
Heyden, M. Vom Reagenzglas in die Zelle. Nachrichten aus der Chemie 2016, 64, 310–313.
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Monaco, M. R.; Properzi, R.; List, B. An Approach to Highly Hindered BINOL Phosphates. Synlett 2016, 27, 591–594.
Zeitschriftenartikel
Leitner, W. Harnessing renewable energy with CO2 for the chemical value chain: challenges and opportunities for catalysis. Philosophical Transactions of the Royal Society A 2016, 374, 20150315.
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Zeitschriftenartikel
Gatzenmeier, T.; van Gemmeren, M.; Xie, Y.; Höfler, D.; Leutzsch, M.; List, B. Asymmetric Lewis acid organocatalysis of the Diels-Alder reaction by a silylated C-H acid. Science 2016, 351, 949–952.
Zeitschriftenartikel
Heggen, B.; Thiel, W. Theoretical investigation on the mechanism of iron catalyzed cross coupling reactions via ferrate intermediates. Journal of Organometallic Chemistry 2016, 804, 42–47.
Zeitschriftenartikel
Li, A.; Acevedo-Rocha, C. G.; Reetz, M. T.; Analysis of Enantioselective Biotransformations Using a Few Hundred Cells on an Integrated Microfluidic Chip. Journal of the American Chemical Society 2016, 138, 2102–2105.
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Zeitschriftenartikel
Deng, X.; Bongard, H.-J.; ; Tüysüz, H. Dual-Templated Cobalt Oxide for Photochemical Water Oxidation. ChemSusChem 2016, 9, 409–415.
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Fang, X.; Peng, Y.; Morandi, B. Catalytic reversible alkene-nitrile interconversion through controllable transfer hydrocyanation. Science 2016, 351, 832–836.
Zeitschriftenartikel
Frihed, T. G.; Fürstner, A. Progress in the trans-Reduction and trans-Hydrometalation of Internal Alkynes. Applications to Natural Product Synthesis. Bulletin of the Chemical Society of Japan 2016, 89, 135–160.
Zeitschriftenartikel
Grewe, T.; Tüysüz, H. Alkali metals incorporated ordered mesoporous tantalum oxide with enhanced photocatalytic activity for water splitting. Journal of Materials Chemistry A 2016, 4, 3007–3017.
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Grewe, T.; ; Tüysüz, H.; Hyperbranched potassium lanthanum titanate perovskite photocatalysts for hydrogen generation. Journal of Materials Chemistry A 2016, 4, 2837–2841.
Zeitschriftenartikel
Atanasov, M.; ; ; ; Neese, F.; ; A four-coordinate cobalt(II) single-ion magnet with coercivity and a very high energy barrier. Nature Communications 2016, 7, 10467.
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Fernandez-Oliva, M.; Sanchez-Garcia, E.; Light and Temperature Control of the Spin State of Bis(p-methoxyphenyl)carbene: a Magnetically Bistable Carbene. Journal of the American Chemical Society 2016, 138, 1622–1629.
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Sokkar, P.; Fernandez-Oliva, M.; Thiel, W.; Sanchez-Garcia, E.; Switching the Spin State of Diphenylcarbene via Halogen Bonding. Journal of the American Chemical Society 2016, 138, 1689–1697.
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Zeitschriftenartikel
Thiel, W. Excited-State Proton-Transfer-Induced Trapping Enhances the Fluorescence Emission of a Locked GFP Chromophore. Journal of Chemical Theory and Computation 2016, 12, 753–764.
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Haldón, E.; Kozma, Á.; Tinnermann, H.; Gu, L.; Goddard, R.; Alcarazo, M. Synthesis and reactivity of α-cationic phosphines: the effect of imidazolinium and amidinium substituents. Dalton Transactions 2016, 45, 1872–1876.