Zeitschriftenartikel (205)
2014
Zeitschriftenartikel
Atanasov, M.; ; ; Bill, E.; Neese, F.; ; A Well-Defined Terminal Vanadium(III) Oxo Complex. Inorganic Chemistry 2014, 53, 11388–11395.
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Zeitschriftenartikel
Retegan, M.; Cox, N.; Pantazis, D. A.; Neese, F. A First-Principles Approach to the Calculation of the on-Site Zero-Field Splitting in Polynuclear Transition Metal Complexes. Inorganic Chemistry 2014, 53, 11785–11793.
Zeitschriftenartikel
Schmidt, W.; ; ; ; ; ; ; Effect of preparation of iron-infiltrated activated carbon catalysts on nitrogen oxide conversion at low temperature. Applied Catalysis B 2014, 160-161, 641–650.
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Fürstner, A. Quelques commentaires sur la catalyse : la recherche fondamentale précède les applications. Some comments about catalysis: Fundamental research precedes applications. Comptes Rendus Chimie 2014, 17, 1065–1070.
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Krech, D.; Zibrowius, B.; Weidenthaler, C.; Felderhoff, M. On the Preparation and Structure of Caesium Aluminium Tetrahydride. European Journal of Inorganic Chemistry 2014, 2014, 5683–5688.
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Weidenthaler, C.; Schmidt, W.; ; ; ; ; ; ; ; Flexibility versus rigidity: what determines the stability of zeolite frameworks? A case study. Materials Horizons 2014, 1, 582–587.
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Fazzi, D.; ; Atomistic Simulations of P(NDI2OD-T2) Morphologies: From Single Chain to Condensed Phases. The Journal of Physical Chemistry B 2014, 118, 12556–12565.
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Barbatti, M. Computational Reference Data for the Photochemistry of Cyclobutane Pyrimidine Dimers. ChemPhysChem 2014, 15, 3342–3354.
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Escudero, D.; Thiel, W. Exploring the Triplet Excited State Potential Energy Surfaces of a Cyclometalated Pt(II) Complex: Is There Non-Kasha Emissive Behavior? Inorganic Chemistry 2014, 53, 11015–11019.
Zeitschriftenartikel
Götze, J.; ; ; Karasulu, B.; Thiel, W. Carotenoids as a Shortcut for Chlorophyll Soret-to-Q Band Energy Flow. ChemPhysChem 2014, 15, 3392–3401.
Zeitschriftenartikel
Lehmann, C. W.; Rapid Asymmetric Synthesis of Highly Functionalized Indanols via a Michael/Henry Organocascade with Submol% Squaramide Catalyst Loadings. Advanced Synthesis & Catalysis 2014, 356, 3181–3186.
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Urbanczyk, R.; Peinecke, K.; Felderhoff, M.; Hauschild, K.; Kersten, W.; ; Aluminium alloy based hydrogen storage tank operated with sodium aluminium hexahydride Na3AlH6. International Journal of Hydrogen Energy 2014, 39, 17118–17128.
Zeitschriftenartikel
Kollmar, C.; Neese, F. The static response function in Kohn-Sham theory: An appropriate basis for its matrix representation in case of finite AO basis sets. The Journal of Chemical Physics 2014, 141, 134106.
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Leitner, W. Ruthenium-Catalyzed Reductive Methylation of Imines Using Carbon Dioxide and Molecular Hydrogen. Angewandte Chemie International Edition 2014, 53, 11010–11014.
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Lhermet, R.; Fürstner, A. Cross-Metathesis of Terminal Alkynes. Chemistry - A European Journal 2014, 20, 13188–13193.
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Goddard, R.; Isomorphous free-base, Ni(II)- and Cu(II)-5,10,15,20-tetra(4-hydroxyphenyl)porphyrin nitrobenzene hexasolvates with tetragonal 3D hydrogen-bonded network structures. CrystEngComm 2014, 16, 10505–10511.
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Zeitschriftenartikel
Liakos, D. G.; Neese, F. On the Reaction Mechanism of the Complete Intermolecular O2 Transfer between Mononuclear Nickel and Manganese Complexes with Macrocyclic Ligands. Chemistry – A European Journal 2014, 20, 13296–13304.
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Deng, X.; Tüysüz, H. Cobalt-Oxide-Based Materials as Water Oxidation Catalyst: Recent Progress and Challenges. ACS Catalysis 2014, 4, 3701–3714.
Zeitschriftenartikel
Farès, C.; ; ; ; ; Enhancing hydrogen production of microalgae by redirecting electrons from photosystem I to hydrogenase. Energy & Environmental Science 2014, 7, 3296–3301.
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Sivalingam, K.; Neese, F.; Low-energy spectrum of iron–sulfur clusters directly from many-particle quantum mechanics. Nature Chemistry 2014, 6, 927–933.
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