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Alessandro Soncini
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PHI: A powerful new program for the analysis of anisotropic monomeric and exchange‐coupled polynuclear d‐ and f‐block complexes
NF Chilton, RP Anderson, LD Turner, A Soncini, KS Murray
Journal of Computational Chemistry 34 (13), 1164-1175, 2013
17332013
The origin of nonmagnetic Kramers doublets in the ground state of dysprosium triangles: evidence for a toroidal magnetic moment
L Chibotaru, L Ungur, A Soncini
Angewandte Chemie-International Edition 47 (22), 4126-4129, 2008
6802008
An electrostatic model for the determination of magnetic anisotropy in dysprosium complexes
NF Chilton, D Collison, EJL McInnes, REP Winpenny, A Soncini
Nature communications 4 (1), 2551, 2013
5632013
Single molecule magnetism in a family of mononuclear β-diketonate lanthanide (III) complexes: rationalization of magnetic anisotropy in complexes of low symmetry
NF Chilton, SK Langley, B Moubaraki, A Soncini, SR Batten, KS Murray
Chemical Science 4 (4), 1719-1730, 2013
2242013
Nonperturbative ab initio calculations in strong magnetic fields using London orbitals
EI Tellgren, A Soncini, T Helgaker
The Journal of chemical physics 129 (15), 2008
1152008
NMR chemical shift as analytical derivative of the Helmholtz free energy
W Van den Heuvel, A Soncini
The Journal of chemical physics 138 (5), 2013
962013
Ferrotoroidic ground state in a heterometallic {CrIIIDyIII6} complex displaying slow magnetic relaxation
KR Vignesh, A Soncini, SK Langley, W Wernsdorfer, KS Murray, ...
Nature communications 8 (1), 1023, 2017
942017
Why downfield proton chemical shifts are not reliable aromaticity indicators
F Faglioni, A Ligabue, S Pelloni, A Soncini, RG Viglione, MB Ferraro, ...
Organic letters 7 (16), 3457-3460, 2005
942005
Perimeter effects on ring currents in polycyclic aromatic hydrocarbons: Circumcoronene and two hexabenzocoronenes
A Soncini, E Steiner, PW Fowler, RWA Havenith, LW Jenneskens
Chemistry–A European Journal 9 (13), 2974-2981, 2003
942003
NMR chemical shift in an electronic state with arbitrary degeneracy
W Van den Heuvel, A Soncini
Physical review letters 109 (7), 073001, 2012
902012
Ring-current aromaticity in open-shell systems
A Soncini, PW Fowler
Chemical Physics Letters 450 (4-6), 431-436, 2008
862008
Toroidal magnetic states in molecular wheels: Interplay between isotropic exchange interactions and local magnetic anisotropy
A Soncini, LF Chibotaru
Physical Review B 77 (22), 220406, 2008
822008
Non-perturbative magnetic phenomena in closed-shell paramagnetic molecules
EI Tellgren, T Helgaker, A Soncini
Physical Chemistry Chemical Physics 11 (26), 5489-5498, 2009
802009
Current-density maps as probes of aromaticity: global and Clar π ring currents in totally resonant polycyclic aromatic hydrocarbons
E Steiner, PW Fowler, A Soncini, LW Jenneskens
Faraday discussions 135, 309-323, 2007
802007
Control of the diatropic π ring current in strained benzenes: Effects of annelation with cyclopropa, cyclobuta, and cyclobutadieno clamping groups
A Soncini, RWA Havenith, PW Fowler, LW Jenneskens, E Steiner
The Journal of Organic Chemistry 67 (14), 4753-4758, 2002
782002
Paratropic delocalized ring currents in flattened cyclooctatetraene systems with bond alternation
PW Fowler, RWA Havenith, LW Jenneskens, A Soncini, E Steiner
Angewandte Chemie International Edition 41 (9), 1558-1560, 2002
742002
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), 2013
712013
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
672017
Full spectral decomposition of ring currents
E Steiner, A Soncini, PW Fowler
The Journal of Physical Chemistry A 110 (47), 12882-12886, 2006
672006
A Unified Orbital Model of Delocalised and Localised Currents in Monocycles, from Annulenes to Azabora‐heterocycles
A Soncini, C Domene, JJ Engelberts, PW Fowler, A Rassat, ...
Chemistry–A European Journal 11 (4), 1257-1266, 2005
672005
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