Serena DeBeer
Serena DeBeer
Professor, Max Planck Institute
Verified email at cec.mpg.de
TitleCited byYear
Electronic structures of metal sites in proteins and models: contributions to function in blue copper proteins
EI Solomon, RK Szilagyi, SDB George, L Basumallick
Chemical Reviews-Columbus 104 (2), 419-458, 2004
7702004
X-ray emission spectroscopy evidences a central carbon in the nitrogenase iron-molybdenum cofactor
KM Lancaster, M Roemelt, P Ettenhuber, Y Hu, MW Ribbe, F Neese, ...
Science 334 (6058), 974-977, 2011
6132011
Nature of the intermediate formed in the reduction of O2 to H2O at the trinuclear copper cluster active site in native laccase
SK Lee, SDB George, WE Antholine, B Hedman, KO Hodgson, ...
Journal of the American Chemical Society 124 (21), 6180-6193, 2002
2992002
An octahedral coordination complex of iron (VI)
JF Berry, E Bill, E Bothe, SDB George, B Mienert, F Neese, K Wieghardt
Science 312 (5782), 1937-1941, 2006
2582006
Synthesis, characterization, and reactivities of manganese (V)-oxo porphyrin complexes
WJ Song, MS Seo, SDB George, T Ohta, R Song, MJ Kang, T Tosha, ...
Journal of the American Chemical Society 129 (5), 1268, 2007
2092007
Prediction of iron K-edge absorption spectra using time-dependent density functional theory
S DeBeer George, T Petrenko, F Neese
The Journal of Physical Chemistry A 112 (50), 12936-12943, 2008
2052008
Probing valence orbital composition with iron Kβ X-ray emission spectroscopy
N Lee, T Petrenko, U Bergmann, F Neese, S DeBeer
Journal of the American Chemical Society 132 (28), 9715-9727, 2010
2012010
Description of the Ground‐State Covalencies of the Bis (dithiolato) Transition‐Metal Complexes from X‐ray Absorption Spectroscopy and Time‐Dependent Density‐Functional Calculations
K Ray, S DeBeer George, EI Solomon, K Wieghardt, F Neese
Chemistry–A European Journal 13 (10), 2783-2797, 2007
1812007
Infrared and Raman characteristic group frequencies: tables and charts
S George
Wiley, New Jersey, 2001
1782001
Infrared and Raman characteristic group frequencies: tables and charts
S George
Wiley, New Jersey, 2001
1782001
Metal oxidation states in biological water splitting
V Krewald, M Retegan, N Cox, J Messinger, W Lubitz, S DeBeer, F Neese, ...
Chemical science 6 (3), 1676-1695, 2015
1752015
Time-dependent density functional calculations of ligand K-edge X-ray absorption spectra
SDB George, T Petrenko, F Neese
Inorganica Chimica Acta 361 (4), 965-972, 2008
1722008
Spectroscopic and Electronic Structural Studies of Blue Copper Model Complexes. 2. Comparison of Three-and Four-Coordinate Cu (II)− Thiolate Complexes and Fungal Laccase
DW Randall, SDB George, PL Holland, B Hedman, KO Hodgson, ...
Journal of the American Chemical Society 122 (47), 11632-11648, 2000
1562000
A quantitative description of the ground-state wave function of CuA by X-ray absorption spectroscopy: comparison to plastocyanin and relevance to electron transfer
SDB George, M Metz, RK Szilagyi, H Wang, SP Cramer, Y Lu, WB Tolman, ...
Journal of the American Chemical Society 123 (24), 5757-5767, 2001
1512001
Sulfur K-edge X-ray absorption spectroscopy as a probe of ligand-metal bond covalency: Metal vs ligand oxidation in copper and nickel dithiolene complexes
R Sarangi, SDB George, DJ Rudd, RK Szilagyi, X Ribas, C Rovira, ...
Journal of the American Chemical Society 129 (8), 2316-2326, 2007
1462007
The Geometric and Electronic Structure of [(cyclam‐acetato)Fe(N)]+: A Genuine Iron(V) Species with a Ground‐State Spin S=1/2
N Aliaga‐Alcalde, S DeBeer George, B Mienert, E Bill, K Wieghardt, ...
Angewandte Chemie International Edition 44 (19), 2908-2912, 2005
1402005
A combined DFT and restricted open-shell configuration interaction method including spin-orbit coupling: Application to transition metal L-edge X-ray absorption spectroscopy
M Roemelt, D Maganas, S DeBeer, F Neese
The Journal of chemical physics 138 (20), 204101, 2013
1362013
Catalytic hydrogenation activity and electronic structure determination of bis (arylimidazol-2-ylidene) pyridine cobalt alkyl and hydride complexes
RP Yu, JM Darmon, C Milsmann, GW Margulieux, SCE Stieber, S DeBeer, ...
Journal of the American Chemical Society 135 (35), 13168-13184, 2013
1292013
Encyclopedia of inorganic and bioinorganic chemistry
PJ Hart, AM Nersissian, SD George
Wiley, 2011
1272011
Electronic and Molecular Structures of the Members of the Electron Transfer Series [Cr (t bpy) 3] n (n= 3+, 2+, 1+, 0): An X-ray Absorption Spectroscopic and Density Functional …
CC Scarborough, S Sproules, T Weyhermüller, S DeBeer, K Wieghardt
Inorganic chemistry 50 (24), 12446-12462, 2011
1142011
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