| Observation of Fe(V)=O using variable-temperature mass spectrometry and its enzyme-like C–H and C=C oxidation reactions I Prat, JS Mathieson, M Güell, X Ribas, JM Luis, L Cronin, M Costas Nature Chemistry 3 (10), 788-793, 2011 | 298 | 2011 |
| Alkane hydroxylation by a nonheme iron catalyst that challenges the heme paradigm for oxygenase action A Company, L Gómez, M Güell, X Ribas, JM Luis, L Que, M Costas Journal of the American Chemical Society 129 (51), 15766-15767, 2007 | 187 | 2007 |
| Importance of the basis set for the spin-state energetics of iron complexes M Güell, JM Luis, M Sola, M Swart The Journal of Physical Chemistry A 112 (28), 6384-6391, 2008 | 177 | 2008 |
| Basis set and electron correlation effects on initial convergence for vibrational nonlinear optical properties of conjugated organic molecules M Torrent-Sucarrat, M Sola, M Duran, JM Luis, B Kirtman The Journal of chemical physics 120 (14), 6346-6355, 2004 | 176 | 2004 |
| Additional compact formulas for vibrational dynamic dipole polarizabilities and hyperpolarizabilities DM Bishop, JM Luis, B Kirtman The Journal of chemical physics 108 (24), 10013-10017, 1998 | 156 | 1998 |
| Electronic Effects on Single-Site Iron Catalysts for Water Oxidation. Z Codolà, I Garcia‐Bosch, F Acuña‐Parés, I Prat, JM Luis, M Costas, ... Chemistry-A European Journal 19 (25), 2013 | 140 | 2013 |
| Carboxylate-Assisted Formation of Aryl-Co (III) Masked-Carbenes in Cobalt-Catalyzed C–H Functionalization with Diazo Esters O Planas, S Roldan-Gomez, V Martin-Diaconescu, T Parella, JM Luis, ... Journal of the American Chemical Society 139 (41), 14649-14655, 2017 | 139 | 2017 |
| On the validity of the maximum hardness and minimum polarizability principles for nontotally symmetric vibrations M Torrent-Sucarrat, JM Luis, M Duran, M Solà Journal of the American Chemical Society 123 (32), 7951-7952, 2001 | 125 | 2001 |
| The role of aromaticity in determining the molecular structure and reactivity of (endohedral metallo) fullerenes M Garcia-Borras, S Osuna, JM Luis, M Swart, M Sola Chemical Society Reviews 43 (14), 5089-5105, 2014 | 121 | 2014 |
| Linear and nonlinear optical properties of [60] fullerene derivatives O Loboda, R Zalesny, A Avramopoulos, JM Luis, B Kirtman, ... The Journal of Physical Chemistry A 113 (6), 1159-1170, 2009 | 117 | 2009 |
| Modeling the cis‐Oxo‐Labile Binding Site Motif of Non‐Heme Iron Oxygenases: Water Exchange and Oxidation Reactivity of a Non‐Heme Iron(IV)‐Oxo Compound … A Company, I Prat, JR Frisch, DR Mas‐Ballesté, M Gueell, G Juhasz, ... Chemistry–A European Journal 17 (5), 1622-1634, 2011 | 107 | 2011 |
| Evaluation of the nonlinear optical properties for annulenes with Huckel and Mobius topologies M Torrent-Sucarrat, JM Anglada, JM Luis Journal of Chemical Theory and Computation 7 (12), 3935-3943, 2011 | 96 | 2011 |
| A Unified Electro- and Photocatalytic CO2 to CO Reduction Mechanism with Aminopyridine Cobalt Complexes S Fernández, F Franco, C Casadevall, V Martin-Diaconescu, JM Luis, ... Journal of the American Chemical Society 142 (1), 120-133, 2019 | 95 | 2019 |
| Simple finite field method for calculation of static and dynamic vibrational hyperpolarizabilities: Curvature contributions B Kirtman, JM Luis, DM Bishop The Journal of chemical physics 108 (24), 10008-10012, 1998 | 94 | 1998 |
| Finite field treatment of vibrational polarizabilities and hyperpolarizabilities: On the role of the Eckart conditions, their implementation, and their use in characterizing … JM Luis, M Duran, JL Andrés, B Champagne, B Kirtman The Journal of chemical physics 111 (3), 875-884, 1999 | 92 | 1999 |
| Determination of vibrational polarizabilities and hyperpolarizabilities using field-induced coordinates JM Luis, M Duran, B Champagne, B Kirtman The Journal of Chemical Physics 113 (13), 5203-5213, 2000 | 89 | 2000 |
| A different approach for calculating Franck–Condon factors including anharmonicity JM Luis, DM Bishop, B Kirtman The Journal of chemical physics 120 (2), 813-822, 2004 | 88 | 2004 |
| Iron and Manganese Catalysts for the Selective Functionalization of Arene C(sp2)−H Bonds by Carbene Insertion A Conde, G Sabenya, M Rodríguez, V Postils, JM Luis, MM Díaz‐Requejo, ... Angewandte Chemie International Edition 55 (22), 6530-6534, 2016 | 86 | 2016 |
| Unraveling the mechanism of water oxidation catalyzed by nonheme iron complexes F Acuña‐Parés, Z Codolà, M Costas, JM Luis, J Lloret‐Fillol Chemistry–A European Journal 20 (19), 5696-5707, 2014 | 86 | 2014 |
| Electronic and vibrational nonlinear optical properties of five representative electrides M Garcia-Borras, M Solà, JM Luis, B Kirtman Journal of Chemical Theory and Computation 8 (8), 2688-2697, 2012 | 85 | 2012 |
Miquel Solà Puig (ORCID: 0000-0002-...University of Girona / Universitat de Girona (GRID grid.5319.e / ROR 01xdxns91)Verified email at udg.edu
