| OpenMolcas: From source code to insight I Fdez. Galván, M Vacher, A Alavi, C Angeli, F Aquilante, J Autschbach, ... Journal of chemical theory and computation 15 (11), 5925-5964, 2019 | 873 | 2019 |
| Assessing the exchange coupling in binuclear lanthanide (III) complexes and the slow relaxation of the magnetization in the antiferromagnetically coupled Dy 2 derivative CY Chow, H Bolvin, VE Campbell, R Guillot, JW Kampf, W Wernsdorfer, ... Chemical Science 6 (7), 4148-4159, 2015 | 135 | 2015 |
| Magnetic Properties and Electronic Structure of Neptunyl (VI) Complexes: Wavefunctions, Orbitals, and Crystal‐Field Models F Gendron, D Páez‐Hernández, FP Notter, B Pritchard, H Bolvin, ... Chemistry–A European Journal 20 (26), 7994-8011, 2014 | 105 | 2014 |
| Characterization of berkelium (III) dipicolinate and borate compounds in solution and the solid state MA Silver, SK Cary, JA Johnson, RE Baumbach, AA Arico, M Luckey, ... Science 353 (6302), aaf3762, 2016 | 94 | 2016 |
| Calculating NMR chemical shifts for paramagnetic metal complexes from first-principles F Gendron, K Sharkas, J Autschbach The Journal of Physical Chemistry Letters 6 (12), 2183-2188, 2015 | 89 | 2015 |
| Hysteresis photomodulation via single-crystal-to-single-crystal isomerization of a photochromic chain of dysprosium single-molecule magnets M Hojorat, H Al Sabea, L Norel, K Bernot, T Roisnel, F Gendron, ... Journal of the American Chemical Society 142 (2), 931-936, 2019 | 85 | 2019 |
| Luminescence, chiroptical, magnetic and ab initio crystal-field characterizations of an enantiopure helicoidal Yb (III) complex F Gendron, S Di Pietro, LA Galán, F Riobé, V Placide, L Guy, F Zinna, ... Inorganic Chemistry Frontiers 8 (4), 914-926, 2021 | 68 | 2021 |
| Magnetic resonance properties of actinyl carbonate complexes and plutonyl (VI)-tris-nitrate F Gendron, B Pritchard, H Bolvin, J Autschbach Inorganic Chemistry 53 (16), 8577-8592, 2014 | 64 | 2014 |
| Single-ion 4f element magnetism: an ab-initio look at Ln (COT) 2− F Gendron, B Pritchard, H Bolvin, J Autschbach Dalton Transactions 44 (46), 19886-19900, 2015 | 63 | 2015 |
| Solid‐State Near‐Infrared Circularly Polarized Luminescence from Chiral YbIII‐Single‐Molecule Magnet B Lefeuvre, CA Mattei, JF Gonzalez, F Gendron, V Dorcet, F Riobé, C Lalli, ... Chemistry–A European Journal 27 (26), 7362-7366, 2021 | 61 | 2021 |
| Low-Spin Fe (III) Macrocyclic Complexes of Imidazole-Appended 1, 4, 7-Triazacyclononane as Paramagnetic Probes PB Tsitovich, F Gendron, AY Nazarenko, BN Livesay, AP Lopez, ... Inorganic Chemistry 57 (14), 8364-8374, 2018 | 54 | 2018 |
| Ligand NMR Chemical Shift Calculations for Paramagnetic Metal Complexes: 5f1 vs 5f2 Actinides F Gendron, J Autschbach Journal of Chemical Theory and Computation 12 (11), 5309-5321, 2016 | 53 | 2016 |
| Hexatriynediyl chain spanning two Cp*(dppe) M termini (M= Fe, Ru): evidence for the dependence of electronic and magnetic couplings on the relative orientation of the termini A Burgun, F Gendron, CJ Sumby, T Roisnel, O Cador, K Costuas, JF Halet, ... Organometallics 33 (10), 2613-2627, 2014 | 47 | 2014 |
| Chiral Supramolecular Nanotubes of Single‐Chain Magnets F Houard, Q Evrard, G Calvez, Y Suffren, C Daiguebonne, O Guillou, ... Angewandte Chemie 132 (2), 790-794, 2020 | 45 | 2020 |
| Electronic structure and properties of berkelium iodates MA Silver, SK Cary, AJ Garza, RE Baumbach, AA Arico, GA Galmin, ... Journal of the American Chemical Society 139 (38), 13361-13375, 2017 | 45 | 2017 |
| Bis‐Cyclooctatetraenyl Thulium (II): Highly Reducing Lanthanide Sandwich Single‐Molecule Magnets J Moutet, J Schleinitz, L La Droitte, M Tricoire, F Pointillart, F Gendron, ... Angewandte Chemie 133 (11), 6107-6111, 2021 | 41 | 2021 |
| Ab initio study of circular dichroism and circularly polarized luminescence of spin-allowed and spin-forbidden transitions: from organic ketones to lanthanide complexes F Gendron, B Moore II, O Cador, F Pointillart, J Autschbach, B Le Guennic Journal of Chemical Theory and Computation 15 (7), 4140-4155, 2019 | 41 | 2019 |
| Iron and Ruthenium σ-Polyynyls of the General Formula [{M(dppe)Cp*}–(CC)n–R]0/+ (M = Fe, Ru): An Experimental and Theoretical Investigation F Gendron, A Burgun, BW Skelton, AH White, T Roisnel, MI Bruce, ... Organometallics 31 (19), 6796-6811, 2012 | 37 | 2012 |
| Magnetic Properties and Electronic Structures of Ar3UIV–L Complexes with Ar = C5(CH3)4H– or C5H5 – and L = CH3, NO, and Cl F Gendron, B Le Guennic, J Autschbach Inorganic Chemistry 53 (24), 13174-13187, 2014 | 33 | 2014 |
| Oxidative Dimerization of Arylalkynyl–Ruthenium Complexes MI Bruce, A Burgun, F Gendron, G Grelaud, JF Halet, BW Skelton Organometallics 30 (10), 2861-2868, 2011 | 31 | 2011 |
Boris Le GuennicInstitut des Sciences Chimiques de RennesOverená e-mailová adresa na: univ-rennes1.fr