Publikationen

Zeitschriftenartikel (5)

2012
Zeitschriftenartikel
Dugan, T. R.; Bill, E.; MacLeod, K. C.; Christian, G. J.; Cowley, R. E.; Brennessel, W. W.; Ye, S.; Neese, F.; Holland, P. L.: Reversible C–C Bond Formation between Redox-Active Pyridine Ligands in Iron Complexes. Journal of the American Chemical Society 134 (50), S. 20352 - 20364 (2012)
Zeitschriftenartikel
Ye, S.; Neese, F.: How Do Heavier Halide Ligands Affect the Signs and Magnitudes of the Zero-Field Splittings in Halogenonickel(II) Scorpionate Complexes? A Theoretical Investigation Coupled to Ligand-Field Analysis. Journal of Chemical Theory and Computation 8 (7), S. 2344 - 2351 (2012)
Zeitschriftenartikel
Ye, S.; Riplinger, C.; Hansen, A.; Krebs, C.; Bollinger Jr., J. M.; Neese, F.: Electronic Structure Analysis of the Oxygen‐Activation Mechanism by FeII‐ and α‐Ketoglutarate (αKG)‐Dependent Dioxygenases. Chemistry – A European Journal 18 (21), S. 6555 - 6567 (2012)
Zeitschriftenartikel
Christian, G. J.; Ye, S.; Neese, F.: Oxygen activation in extradiol catecholate dioxygenases – a density functional study. Chemical Science 3 (5), S. 1600 - 1611 (2012)
Zeitschriftenartikel
Desrochers, P. J.; Sutton, C. A.; Abrams, M. L.; Ye, S.; Neese, F.; Telser, J.; Ozarowski, A.; Krzystek, J.: Electronic Structure of Nickel(II) and Zinc(II) Borohydrides from Spectroscopic Measurements and Computational Modeling. Inorganic Chemistry 51 (5), S. 2793 - 2805 (2012)

Buchkapitel (1)

2012
Buchkapitel
DeBeer, S.; van Gastel, M.; Bill, E.; Ye, S.; Petrenko, T.; Pantazis, D. A.; Neese, F.: 4.5 Challenges in Molecular Energy Research. In: Chemical Energy Storage (Hg. Schlögl, R.). Walter De Gruyter, Berlin (2012)
Zur Redakteursansicht