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ZORA Publikationsliste

Publikationen

• García-Domínguez, P., & Nevado, C. (2016). Au–Pd bimetallic catalysis: the importance of anionic ligands in catalyst speciation Journal of the American Chemical Society, 138, 3266–3269. https://doi.org/10.1021/jacs.5b10277
• Li, Y., Blacque, O., Fox, T., Luber, S., Polit, W., Winter, R. F., Venkatesan, K., & Berke, H. (2016). Electronic communication in phosphine substituted bridged dirhenium complexes – clarifying ambiguities raised by the redox non-innocence of the C4H2- and C4-bridges Dalton Transactions, 45, 5783–5799. https://doi.org/10.1039/c5dt04768d
• Schwarz, F., Koch, M., Kastlunger, G., Berke, H., Stadler, R., Venkatesan, K., & Lörtscher, E. (2016). Charge Transport and Conductance Switching of Redox-Active Azulene Derivatives Angewandte Chemie Internationale Edition, 55, 11781–11786. https://doi.org/10.1002/anie.201605559
• Veliks, J., Seifert, H. M., Frantz, D. K., Klosterman, J. K., Tseng, J.-C., Linden, A., & Siegel, J. S. (2016). Towards the molecular Borromean link with three unequal rings: double-threaded ruthenium(ii) ring-in-ring complexes Organic Chemistry Frontiers, 3, 667–672. https://doi.org/10.1039/c6qo00025h
• Krikorian, M., Voll, C.-C. A., Yoon, M., Venkatesan, K., Kouwer, P. H. J., & Swager, T. M. (2016). Smectic A mesophases from luminescent sandic platinum(II) mesogens Liquid Crystals, 43, 1709–1713. https://doi.org/10.1080/02678292.2016.1200679
• Unzue, A., Xu, M., Dong, J., Wiedmer, L., Spiliotopoulos, D., Caflisch, A., & Nevado, C. (2016). Fragment-based design of selective nanomolar ligands of the crebbp bromodomain Journal of Medicinal Chemistry, 59, 1350–1356. https://doi.org/10.1021/acs.jmedchem.5b00172
• Schilling, M., Patzke, G. R., Hutter, J., & Luber, S. (2016). Computational investigation and design of cobalt aqua complexes for homogeneous water oxidation Journal of Physical Chemistry C, 120, 7966–7975. https://doi.org/10.1021/acs.jpcc.6b00712
• Einrem, R. F., Braband, H., Fox, T., Vazquez-Lima, H., Alberto, R., & Ghosh, A. (2016). Synthesis and Molecular Structure of 99Tc Corroles Chemistry, 22, 18747–18751. https://doi.org/10.1002/chem.201605015
• Steffen, F. D., Sigel, R. K. O., & Börner, R. (2016). An atomistic view on carbocyanine photophysics in the realm of RNA Physical Chemistry Chemical Physics (PCCP), 18, 29045–29055. https://doi.org/10.1039/c6cp04277e
• Herrera, A., Briceño, A., Gonzalez, T., Linden, A., Heinemann, F. W., Agrifoglio, G., Pastrán, J., & Dorta, R. (2016). Camphopyrazole-based N,N- and N,P-ligands and chiral complexes of Ni, Pd, and Rh: P–N bond activation upon Rh(I) complexation Tetrahedron: Asymmetry, 27, 759–767. https://doi.org/10.1016/j.tetasy.2016.06.013
• Ruiz-Sola, M. Á., Coman, D., Beck, G., Barja, M. V., Colinas, M., Graf, A., Welsch, R., Rütimann, P., Bühlmann, P., Bigler, L., Gruissem, W., Rodríguez-Concepción, M., & Vranová, E. (2016). Arabidopsis GERANYLGERANYL DIPHOSPHATE SYNTHASE 11 is a hub isozyme required for the production of most photosynthesis-related isoprenoids New Phytologist, 209, 252–264. https://doi.org/10.1111/nph.13580
• Dorta, R., Herrera, A., Linden, A., Heinemann, F., Brachvogel, R.-C., & von Delius, M. (2016). Optimized syntheses of optically pure p-alkene ligands: crystal structures of a pair of p-stereogenic diastereomers Synthesis, 48, 1117–1121. https://doi.org/10.1055/s-0035-1560410
• Li, Y., Blacque, O., Fox, T., Luber, S., Polit, W., Winter, R. F., Venkatesan, K., & Berke, H. (2016). Electronic communication in phosphine substituted bridged dirhenium complexes – clarifying ambiguities raised by the redox non-innocence of the C4H2- and C4-bridges Dalton Transactions, 45, 5783–5799. https://doi.org/10.1039/C5DT04768D
• Wang, F., Wei, S., Zhang, Z., Patzke, G. R., & Zhou, Y. (2016). Oxygen vacancies as active sites for H$_2$S dissociation on the rutile TiO$_2$(110) surface: a first-principles study Physical Chemistry Chemical Physics (PCCP), 18, 6706–6712. https://doi.org/10.1039/C5CP06835E
• Zhang, C., Hutter, J., & Sprik, M. (2016). Computing the Kirkwoodg-Factor by Combining Constant Maxwell Electric Field and Electric Displacement Simulations: Application to the Dielectric Constant of Liquid Water Journal of Physical Chemistry Letters, 7, 2696–2701. https://doi.org/10.1021/acs.jpclett.6b01127
• Shenar-Jackson, L. (2016). Ab initio computational methodologies for investigation of excited state processes: structural-functional relations in electron transfer reactivity in organic molecules (Dissertation, University of Zurich) https://doi.org/10.5167/uzh-204593
• Satoh, H., Oda, T., Nakakoji, K., Uno, T., Tanaka, H., Iwata, S., & Ohno, K. (2016). Potential energy surface-based automatic deduction of conformational transition networks and its application on quantum mechanical landscapes of d-glucose conformers Journal of Chemical Theory and Computation, 12, 5293–5308. https://doi.org/10.1021/acs.jctc.6b00439
• Gurdal, Y., & Keskin, S. (2016). A new approach for predicting gas separation performances of MOF membranes Journal of Membrane Science, 519, 45–54. https://doi.org/10.1016/j.memsci.2016.07.039
• Oulevey, P., Luber, S., Varnholt, B., & Bürgi, T. (2016). Symmetry breaking in chiral ionic liquids evidenced by vibrational optical activity Angewandte Chemie Internationale Edition, 55, 11787–11790. https://doi.org/10.1002/anie.201605792

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