| Ab initio investigation of the non-collinear magnetic structure and the lowest magnetic excitations in dysprosium triangles L Ungur, W Van den Heuvel, LF Chibotaru New Journal of Chemistry 33 (6), 1224-1230, 2009 | 357 | 2009 |
| An Octanuclear [CrIII4DyIII4] 3d–4f Single‐Molecule Magnet J Rinck, G Novitchi, W Van den Heuvel, L Ungur, Y Lan, W Wernsdorfer, ... Angewandte Chemie International Edition 49 (41), 7583-7587, 2010 | 272* | 2010 |
| First heterotrimetallic {3d-4d-4f} single chain magnet, constructed from anisotropic high-spin heterometallic nodes and paramagnetic spacers D Visinescu, AM Madalan, M Andruh, C Duhayon, JP Sutter, L Ungur, ... Chem.-Eur. J 15 (44), 11808-11814, 2009 | 219 | 2009 |
| NMR chemical shift as analytical derivative of the Helmholtz free energy W Van den Heuvel, A Soncini The Journal of Chemical Physics 138, 054113, 2013 | 96 | 2013 |
| NMR chemical shift in an electronic state with arbitrary degeneracy W Van den Heuvel, A Soncini Physical review letters 109 (7), 073001, 2012 | 90 | 2012 |
| Communication: Paramagnetic NMR chemical shift in a spin state subject to zero-field splitting A Soncini, W Van den Heuvel The Journal of Chemical Physics 138 (2), 021103, 2013 | 72 | 2013 |
| Magnetic excitations in polyoxotungstate-supported lanthanoid single-molecule magnets: an inelastic neutron scattering and ab initio study M Vonci, MJ Giansiracusa, W Van den Heuvel, RW Gable, B Moubaraki, ... Inorganic Chemistry 56 (1), 378-394, 2017 | 67 | 2017 |
| Dysprosium-based experimental representatives of an Ising-Heisenberg chain and a decorated Ising ring W Van den Heuvel, LF Chibotaru Physical Review B 82 (17), 174436, 2010 | 59 | 2010 |
| Carbonate-bridged lanthanoid triangles: single-molecule magnet behavior, inelastic neutron scattering, and Ab initio studies MJ Giansiracusa, M Vonci, W Van den Heuvel, RW Gable, B Moubaraki, ... Inorganic Chemistry 55 (11), 5201-5214, 2016 | 43 | 2016 |
| Relay-Like Exchange Mechanism through a Spin Radical between TbPc2 Molecules and Graphene/Ni(111) Substrates S Marocchi, A Candini, D Klar, W Van den Heuvel, H Huang, F Troiani, ... ACS nano 10 (10), 9353-9360, 2016 | 35 | 2016 |
| Ab initio calculations as a quantitative tool in the inelastic neutron scattering study of a single-molecule magnet analogue M Vonci, MJ Giansiracusa, RW Gable, W Van den Heuvel, K Latham, ... Chemical communications 52 (10), 2091-2094, 2016 | 35 | 2016 |
| Configuration-averaged 4f orbitals in ab initio calculations of low-lying crystal field levels in lanthanide (iii) complexes W Van den Heuvel, S Calvello, A Soncini Physical Chemistry Chemical Physics 18 (23), 15807-15814, 2016 | 23 | 2016 |
| Ultralow blocking temperature and breakdown of the giant spin model in Er 3+-doped nanoparticles W Van den Heuvel, VK Tikhomirov, D Kirilenko, N Schildermans, ... Physical Review B 82 (9), 094421, 2010 | 17 | 2010 |
| Titanium (III) Member of the Family of Trigonal Building Blocks with Scorpionate and Cyanide Ligands A Brown, M Saber, W Van den Heuvel, K Schulte, A Soncini, KR Dunbar Inorganic Chemistry 56 (3), 1031-1035, 2017 | 16 | 2017 |
| Basic exchange model: Comparison of Anderson and valence bond configuration interaction approaches and an alternative exchange expression W Van den Heuvel, LF Chibotaru Physical Review B 76 (10), 104424, 2007 | 13 | 2007 |
| A CASPT2 study of the electronic spectrum of hexacyanoosmate (III) W Van den Heuvel, MFA Hendrickx, A Ceulemans Inorganic chemistry 46 (19), 8032-8037, 2007 | 13 | 2007 |
| Elucidation of the Magnetism of [Co2PdCl2(dpa)4]: Origin of a Large Temperature Domain of TIP Behavior W Van den Heuvel, LF Chibotaru Inorganic chemistry 48 (16), 7557-7563, 2009 | 12 | 2009 |
| Lanthanide-Radical Magnetic Coupling in [LnPc2] 0: Competing Exchange Mechanisms Captured via Ab Initio Multi-Reference Calculations H Haibei, W Van den Heuvel, A Soncini Quantum Materials Research-Special Virtual Issue: Single Molecule Magnets-In …, 2020 | 9 | 2020 |
| Ferromagnetic coupling induced by spin-orbit coupling in dipyridylamide linear trinuclear Cu-Pd-Cu and Cu-Pt-Cu complexes D Maynau, H Bolvin, W Van den Heuvel, M Bénard, MM Rohmer, ... Comptes Rendus. Chimie 15 (2-3), 170-175, 2012 | 4 | 2012 |
| Multiconfigurational SCF and Short-Range DFT Combined with Polarizable Density Embedding: Comparison of Linear-Response and State-Specific Solvatochromic Shifts of Acrolein and … W Van den Heuvel, P Reinholdt, HJA Jensen, J Kongsted Journal of Chemical Theory and Computation 18 (10), 6231-6239, 2022 | 2 | 2022 |
Alessandro SonciniAssociate Professor, University of PadovaVerified email at unipd.it
