| Two-step spin crossover in the new dinuclear compound [Fe (bt)(NCS) 2] 2bpym, with bt= 2, 2'-bi-2-thiazoline and bpym= 2, 2'-bipyrimidine: experimental investigation and … JA Real, H Bolvin, A Bousseksou, A Dworkin, O Kahn, F Varret, ... Journal of the American Chemical Society 114 (12), 4650-4658, 1992 | 329 | 1992 |
| An alternative approach to the g‐matrix: Theory and applications H Bolvin ChemPhysChem: A European Journal of Chemical Physics and Physical Chemistry …, 2006 | 195 | 2006 |
| Magnetic memory effect in a transuranic mononuclear complex N Magnani, C Apostolidis, A Morgenstern, E Colineau, JC Griveau, ... Angewandte Chemie 123 (7), 1734-1736, 2011 | 166 | 2011 |
| 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 | 128 | 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 |
| Single-ion magnet behaviour in [U (Tp Me2) 2 I] JT Coutinho, MA Antunes, LCJ Pereira, H Bolvin, J Marçalo, M Mazzanti, ... Dalton Transactions 41 (44), 13568-13571, 2012 | 102 | 2012 |
| Unique Definition of the Zeeman-Splitting Tensor of a Kramers Doublet LF Chibotaru, A Ceulemans, H Bolvin Physical review letters 101 (3), 033003, 2008 | 75 | 2008 |
| On the structure of Np (VI) and Np (VII) species in alkaline solution studied by EXAFS and quantum chemical methods H Bolvin, U Wahlgren, H Moll, T Reich, G Geipel, T Fanghänel, I Grenthe The Journal of Physical Chemistry A 105 (51), 11441-11445, 2001 | 73 | 2001 |
| 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 | 64 | 2015 |
| 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 | 62 | 2014 |
| d→ d Spectrum and High-Spin/Low-Spin Competition in d6 Octahedral Coordination Compounds: ab Initio Study of Potential Energy Curves H Bolvin The Journal of Physical Chemistry A 102 (38), 7525-7534, 1998 | 62 | 1998 |
| Ising model for low-spin high-spin transitions in molecular compounds; within and beyond the mean-field approximation H Bolvin, O Kahn Chemical physics 192 (3), 295-305, 1995 | 61 | 1995 |
| Structural and electronic dependence of the single-molecule-magnet behavior of dysprosium (III) complexes VE Campbell, H Bolvin, E Rivière, R Guillot, W Wernsdorfer, T Mallah Inorganic Chemistry 53 (5), 2598-2605, 2014 | 60 | 2014 |
| Theoretical Determination of the Excited States and of g-Factors of the Creutz−Taube Ion, [(NH3)5−Ru−pyrazine−Ru−(NH3)5]5+ H Bolvin Inorganic chemistry 46 (2), 417-427, 2007 | 56 | 2007 |
| Optical and magnetic properties of the 5f1AnX6q− series: A theoretical study FP Notter, H Bolvin The Journal of chemical physics 130 (18), 2009 | 52 | 2009 |
| Uranyl Complexation in Fluorinated Acids (HF, HBF4, HPF6, HTf2N): A Combined Experimental and Theoretical Study C Gaillard, A El Azzi, I Billard, H Bolvin, C Hennig Inorganic chemistry 44 (4), 852-861, 2005 | 45 | 2005 |
| Tools for predicting the nature and magnitude of magnetic anisotropy in transition metal complexes: application to Co (II) complexes B Cahier, R Maurice, H Bolvin, T Mallah, N Guihéry Magnetochemistry 2 (3), 31, 2016 | 40 | 2016 |
| The electronic structure of the triiodide ion from relativistic correlated calculations: A comparison of different methodologies ASP Gomes, L Visscher, H Bolvin, T Saue, S Knecht, T Fleig, E Eliav The Journal of chemical physics 133 (6), 2010 | 40 | 2010 |
| Zero field splitting of the chalcogen diatomics using relativistic correlated wave-function methods JB Rota, S Knecht, T Fleig, D Ganyushin, T Saue, F Neese, H Bolvin The Journal of chemical physics 135 (11), 2011 | 37 | 2011 |
| Derivation of lanthanide series crystal field parameters from first principles J Jung, MA Islam, VL Pecoraro, T Mallah, C Berthon, H Bolvin Chemistry–A European Journal 25 (66), 15112-15122, 2019 | 36 | 2019 |
