| 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 | 983 | 2011 |
| 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 | 927 | 2004 |
| 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 | 381 | 2002 |
| 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 | 340 | 2015 |
| 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 | 328 | 2006 |
| 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 | 318 | 2010 |
| 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 | 315 | 2008 |
| Infrared and Raman characteristic group frequencies: tables and charts S George Wiley, New Jersey, 2001 | 296 | 2001 |
| Infrared and Raman characteristic group frequencies: tables and charts S George Wiley, New Jersey, 2001 | 296 | 2001 |
| 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), 2013 | 268 | 2013 |
| 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 | 267 | 2007 |
| 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 | 259 | 2008 |
| 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 | 252 | 2007 |
| Characterization of porphyrin-Co (III)-‘nitrene radical’species relevant in catalytic nitrene transfer reactions M Goswami, V Lyaskovskyy, SR Domingos, WJ Buma, S Woutersen, ... Journal of the American Chemical Society 137 (16), 5468-5479, 2015 | 216 | 2015 |
| 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 | 215 | 2013 |
| 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 | 208 | 2007 |
| Identification of a spin-coupled Mo (III) in the nitrogenase iron–molybdenum cofactor R Bjornsson, FA Lima, T Spatzal, T Weyhermueller, P Glatzel, E Bill, ... Chemical Science 5 (8), 3096-3103, 2014 | 207 | 2014 |
| Modern X-ray spectroscopy: XAS and XES in the laboratory P Zimmermann, S Peredkov, PM Abdala, S DeBeer, M Tromp, C Müller, ... Coordination Chemistry Reviews 423, 213466, 2020 | 188 | 2020 |
| 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 | 183 | 2000 |
| Electronic and Molecular Structures of the Members of the Electron Transfer Series [Cr(tbpy)3]n (n = 3+, 2+, 1+, 0): An X-ray Absorption Spectroscopic and … CC Scarborough, S Sproules, T Weyhermüller, S DeBeer, K Wieghardt Inorganic chemistry 50 (24), 12446-12462, 2011 | 176 | 2011 |