Publikationen

Zeitschriftenartikel (10)

2016
Zeitschriftenartikel
Krewald, V.; Pantazis, D. A. Understanding and tuning the properties of redox-accumulating manganese helicates. Dalton Transactions 2016, 45, 18900–18908.
Zeitschriftenartikel
Burton, K. M. E.; Pantazis, D. A.; Belli, R. G.; McDonald, R.; Rosenberg, L. Alkene Insertions into a Ru–PR2 Bond. Organometallics 2016, 35, 3970–3980.
Zeitschriftenartikel
Christoforidis, K. C.; Pantazis, D. A.; Bonilla, L. L.; Bletsa, E.; Louloudi, M.; Deligiannakis, Y. Axial ligand effect on the catalytic activity of biomimetic Fe-porphyrin catalyst: An experimental and DFT study. Journal of Catalysis 2016, 344, 768–777.
Zeitschriftenartikel
Retegan, M.; Pantazis, D. A. Interaction of methanol with the oxygen-evolving complex: atomistic models, channel identification, species dependence, and mechanistic implications. Chemical Science 2016, 7, 6463–6476.
Zeitschriftenartikel
Isegawa, M.; Neese, F.; Pantazis, D. A. Ionization Energies and Aqueous Redox Potentials of Organic Molecules: Comparison of DFT, Correlated ab Initio Theory and Pair Natural Orbital Approaches. Journal of Chemical Theory and Computation 2016, 12, 2272–2284.
Zeitschriftenartikel
Krewald, V.; Neese, F.; Pantazis, D. A. Redox potential tuning by redox-inactive cations in nature's water oxidizing catalyst and synthetic analogues. Physical Chemistry Chemical Physics 2016, 18, 10739–10750.
Zeitschriftenartikel
Pérez-Navarro, M.; Neese, F.; Lubitz, W.; Pantazis, D. A.; Cox, N. Recent developments in biological water oxidation. Current Opinion in Chemical Biology 2016, 31, 113–119.
Zeitschriftenartikel
Aravena, D.; Neese, F.; Pantazis, D. A. Improved Segmented All-Electron Relativistically Contracted Basis Sets for the Lanthanides. Journal of Chemical Theory and Computation 2016, 12, 1148–1156.
Zeitschriftenartikel
Krewald, V.; Retegan, M.; Neese, F.; Lubitz, W.; Pantazis, D. A.; Cox, N. Spin State as a Marker for the Structural Evolution of Nature’s Water-Splitting Catalyst. Inorganic Chemistry 2016, 55, 488–501.
Zeitschriftenartikel
Retegan, M.; Krewald, V.; Mamedov, F.; Neese, F.; Lubitz, W.; Cox, N.; Pantazis, D. A. A five-coordinate Mn(IV) intermediate in biological water oxidation: spectroscopic signature and a pivot mechanism for water binding. Chemical Science 2016, 7, 72–84.

Buchkapitel (1)

2016
Buchkapitel
Krewald, V.; Retegan, M.; Pantazis, D. A. Principles of Natural Photosynthesis; Tüysüz, H., Chan, C. K., Hrsg.; Tüysüz, H., Chan, C. K., Hrsg.; Topics in Current Chemistry 371-Solar Energy for Fuels; Springer: Cham, 2016; Bd. 371, S 23–48.
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