| Coordination polymer structure and revisited hydrogen evolution catalytic mechanism for amorphous molybdenum sulfide PD Tran, TV Tran, M Orio, S Torelli, QD Truong, K Nayuki, Y Sasaki, ... Nature materials 15 (6), 640-646, 2016 | 543 | 2016 |
| Density functional theory M Orio, DA Pantazis, F Neese Photosynthesis research 102, 443-453, 2009 | 451 | 2009 |
| Nickel-centred proton reduction catalysis in a model of [NiFe] hydrogenase D Brazzolotto, M Gennari, N Queyriaux, TR Simmons, J Pécaut, ... Nature chemistry 8 (11), 1054-1060, 2016 | 227 | 2016 |
| X‐Ray Structures of Copper (II) and Nickel (II) Radical Salen Complexes: The Preference of Galactose Oxidase for Copper (II) M Orio, O Jarjayes, H Kanso, C Philouze, F Neese, F Thomas Angewandte Chemie 122 (29), 5109-5112, 2010 | 203 | 2010 |
| Structure of the oxygen-evolving complex of photosystem II: information on the S 2 state through quantum chemical calculation of its magnetic properties DA Pantazis, M Orio, T Petrenko, S Zein, W Lubitz, J Messinger, F Neese Physical Chemistry Chemical Physics 11 (31), 6788-6798, 2009 | 145 | 2009 |
| Pulsed‐EPR Evidence of a Manganese (II) Hydroxycarbonyl Intermediate in the Electrocatalytic Reduction of Carbon Dioxide by a Manganese Bipyridyl Derivative M Bourrez, M Orio, F Molton, H Vezin, C Duboc, A Deronzier, ... Angewandte Chemie International Edition 53 (1), 240-243, 2014 | 143 | 2014 |
| A new quantum chemical approach to the magnetic properties of oligonuclear transition‐metal complexes: application to a model for the Tetranuclear manganese cluster of … DA Pantazis, M Orio, T Petrenko, S Zein, E Bill, W Lubitz, J Messinger, ... Chemistry–A European Journal 15 (20), 5108-5123, 2009 | 143 | 2009 |
| Magnetic and spectroscopic properties of mixed valence manganese (III, IV) dimers: a systematic study using broken symmetry density functional theory M Orio, DA Pantazis, T Petrenko, F Neese Inorganic chemistry 48 (15), 7251-7260, 2009 | 117 | 2009 |
| Theoretical magnetochemistry of dinuclear manganese complexes: broken symmetry density functional theory investigation on the influence of bridging motifs on structure and … DA Pantazis, V Krewald, M Orio, F Neese Dalton Transactions 39 (20), 4959-4967, 2010 | 114 | 2010 |
| Ligand contributions to the electronic structures of the oxidized cobalt (II) salen complexes A Kochem, H Kanso, B Baptiste, H Arora, C Philouze, O Jarjayes, H Vezin, ... Inorganic chemistry 51 (20), 10557-10571, 2012 | 106 | 2012 |
| Radical Localization in a Series of Symmetric NiII Complexes with Oxidized Salen Ligands L Chiang, A Kochem, O Jarjayes, TJ Dunn, H Vezin, M Sakaguchi, ... Chemistry–A European Journal 18 (44), 14117-14127, 2012 | 94 | 2012 |
| Copper (II) complexes of phenanthroline and histidine containing ligands: Synthesis, characterization and evaluation of their DNA cleavage and cytotoxic activity SMG Leite, LMP Lima, S Gama, F Mendes, M Orio, I Bento, A Paulo, ... Inorganic Chemistry 55 (22), 11801-11814, 2016 | 74 | 2016 |
| A thiosemicarbazone–nickel (II) complex as efficient electrocatalyst for hydrogen evolution T Straistari, J Fize, S Shova, M Réglier, V Artero, M Orio ChemCatChem 9 (12), 2262-2268, 2017 | 73 | 2017 |
| One‐Electron Oxidized Copper (II) Salophen Complexes: Phenoxyl versus Diiminobenzene Radical Species A Kochem, O Jarjayes, B Baptiste, C Philouze, H Vezin, K Tsukidate, ... Chemistry–A European Journal 4 (18), 1068-1072, 2012 | 73 | 2012 |
| Trinuclear Terpyridine Frustrated Spin System with a MnIV3O4 Core: Synthesis, Physical Characterization, and Quantum Chemical Modeling of Its Magnetic … C Baffert, M Orio, DA Pantazis, C Duboc, AG Blackman, G Blondin, ... Inorganic chemistry 48 (21), 10281-10288, 2009 | 59 | 2009 |
| Iminosemiquinone radical ligands enable access to a well-defined redox-active Cu II–CF 3 complex J Jacquet, E Salanouve, M Orio, H Vezin, S Blanchard, E Derat, ... Chemical communications 50 (72), 10394-10397, 2014 | 56 | 2014 |
| Spin interaction in octahedral zinc complexes of mono-and diradical Schiff and Mannich bases M Orio, C Philouze, O Jarjayes, F Neese, F Thomas Inorganic chemistry 49 (2), 646-658, 2010 | 54 | 2010 |
| Hydrogen evolution reactions catalyzed by a bis (thiosemicarbazone) cobalt complex: an experimental and theoretical study T Straistari, R Hardré, J Fize, S Shova, M Giorgi, M Réglier, V Artero, ... Chemistry–A European Journal 24 (35), 8779-8786, 2018 | 53 | 2018 |
| Tuning reactivity of bioinspired [NiFe]-hydrogenase models by ligand design and modeling the CO inhibition process D Brazzolotto, L Wang, H Tang, M Gennari, N Queyriaux, C Philouze, ... ACS Catalysis 8 (11), 10658-10667, 2018 | 52 | 2018 |
| Reversible apical coordination of imidazole between the Ni (III) and Ni (II) oxidation states of a dithiolate complex: A process related to the Ni superoxide dismutase M Gennari, M Orio, J Pécaut, F Neese, MN Collomb, C Duboc Inorganic chemistry 49 (14), 6399-6401, 2010 | 50 | 2010 |
Frank NeeseMax Planck Institute für KohlenforschungVerified email at kofo.mpg.de
