Papers
Among my recent papers, this is a selection of those that (a) I consider
interesting and (b) are published in journals that allow the authors to share
their work:
- Rational Design of Lanthanoid Single-Ion Magnets: Predictive Power of the Theoretical Models (CaEJ, 2016, DOI: 10.1002/chem.201601741)
- Switching of Slow Magnetic Relaxation Dynamics in Mononuclear Dysprosium (III) Compounds with Charge Density (IC, 2016, DOI: 10.1021/acs.inorgchem.6b00410)
- Enhancing coherence in molecular spin qubits via atomic clock transitions (Nature, 2016, DOI: 10.1038/nature16984)
- SIMPRE1. 2: Considering the hyperfine and quadrupolar couplings and the nuclear spin bath decoherence (JCC, 2016, DOI: 10.1002/jcc.24313)
- Single ion magnets based on lanthanoid polyoxomolybdate complexes (DT, 2016, DOI: 10.1039/c6dt02258h)
- Coherence and organisation in lanthanoid complexes: from single ion magnets to spin qubits (ICF, 2016, DOI: 10.1039/C5QI00296F)
- Theoretical evaluation of lanthanide binding tags as biomolecular handles for the organization of single ion magnets and spin qubits (ICF, 2016, DOI: 10.1039/C5QI00127G)
- Molecular spin qubits based on lanthanide ions encapsulated in cubic polyoxopalladates: design
criteria to enhance quantum coherence (ICF, 2015, DOI: 10.1039/C5QI00142K)
- Quantum Error Correction with magnetic molecules (EPL, 2015, 110, 33001)
-
Modeling the magnetic properties of lanthanide complexes: relationship
of the REC parameters with Pauling electronegativity and coordination
number (Dalton Trans., 2015, 44, 12535-12538)
- Coherent manipulation of spin qubits based on polyoxometalates: the case of the single-ion magnet [GdW30P5O110]12- (Chem. Commun., 2013, 49, 8922-8924)
- Modeling the properties of uranium-based single ion magnets (Chem. Sci., 2013, 4, 938)
- Modelling electric field control of the spin state in the mixed-valence polyoxometalate [GeV14O40]8- (Chem. Commun., 2013, 49, 9621)
- Modeling the properties of lanthanoid single-ion magnets using an effective point-charge approach (Dalton Trans., 2012, 41, 13705)
- Magnetic polyoxometalates: from molecular magnetism to molecular spintronics and quantum computing (Chem. Soc. Rev., 2012, 41, 7464-7478)
- Multi-frequency EPR studies of a mononuclear holmium single-molecule magnet based on the polyoxometalate [HoIII(W5O18)2]9- (Dalton Trans., 2012, 41, 13697)
- Gd-based Single-Ion Magnets with tunable magnetic anisotropy: Molecular design of spin qubits (PRL 108, 247213 (2012))
- Spin-based quantum computers made by chemistry: hows and whys (J. Mater. Chem., 2009, 19, 1718)
