Molecular magnets and surfaces: A promising marriage. A DFT insight

A Caneschi, D Gatteschi, F Totti - Coordination Chemistry Reviews, 2015 - Elsevier
A survey about the characterization of molecular magnets adsorbed on surfaces by density
functional methods studied in our laboratory is presented. Several computational issues …

Quantum dynamics of a single molecule magnet on superconducting Pb (111)

G Serrano, L Poggini, M Briganti, AL Sorrentino… - Nature materials, 2020 - nature.com
Magnetic materials interfaced with superconductors may reveal new physical phenomena
with potential for quantum technologies. The use of molecules as magnetic components has …

Propeller‐Shaped Fe4 and Fe3M Molecular Nanomagnets: A Journey from Crystals to Addressable Single Molecules

A Cornia, M Mannini, R Sessoli… - European Journal of …, 2019 - Wiley Online Library
This Microreview covers the preparation and investigation of Fe4 and Fe3M complexes with
a propeller‐like structure, most of which function as single‐molecule magnets (SMMs). The …

Magnetic Bistability in a Submonolayer of Sublimated Fe4 Single-Molecule Magnets

L Malavolti, V Lanzilotto, S Ninova, L Poggini… - Nano …, 2015 - ACS Publications
We demonstrate that Fe4 molecules can be deposited on gold by thermal sublimation in
ultra-high vacuum with retention of single molecule magnet behavior. A magnetic hysteresis …

Magnetic fingerprint of individual Fe4 molecular magnets under compression by a scanning tunnelling microscope

JAJ Burgess, L Malavolti, V Lanzilotto… - Nature …, 2015 - nature.com
Single-molecule magnets (SMMs) present a promising avenue to develop spintronic
technologies. Addressing individual molecules with electrical leads in SMM-based …

Assembling Fe 4 single-molecule magnets on a TiO 2 monolayer

AL Sorrentino, L Poggini, G Serrano, G Cucinotta… - Nanoscale, 2024 - pubs.rsc.org
The decoration of technologically relevant surfaces, such as metal oxides, with Single-
Molecule Magnets (SMMs) constitutes a persistent challenge for the integration of these …

Magnetic anisotropy on demand exploiting high-pressure as remote control: an ab initio proof of concept

M Briganti, F Totti - Dalton Transactions, 2021 - pubs.rsc.org
Lanthanide based single molecule magnets have recently become very promising systems
for creating single molecule devices working at high temperatures (nitrogen boiling …

Accurate prediction of pressure and temperature T 1/2 variation in solid state spin crossover by ab initio methods: the [Co II (dpzca) 2] case

L Bondì, S Brooker, F Totti - Journal of Materials Chemistry C, 2021 - pubs.rsc.org
The spin crossover (SCO) phenomenon is among the most complicated second-order
transitions to be modelled from first principles. Some ad hoc strategies have been successful …

Single molecule magnets grafted on gold: magnetic properties from ab initio molecular dynamics

A Lunghi, M Iannuzzi, R Sessoli, F Totti - Journal of Materials Chemistry …, 2015 - pubs.rsc.org
The computational characterization of the single molecule magnet (SMM)[Fe4 (AcS (CH2)
5C (CH2O) 3) 2 (dpm) 6](Fe4C5) with Ac= CH3CO and Hdpm= dipivaloylmethane, grafted …

Chiral Co3Y Propeller-Shaped Chemosensory Platforms Based on 19F-NMR

G Audsley, H Carpenter, NB Essien… - Inorganic …, 2023 - ACS Publications
Two propeller-shaped chiral CoIII3YIII complexes built from fluorinated ligands are
synthesized and characterized by single-crystal X-ray diffraction (SXRD), IR, UV–vis, circular …