Molecular magnetism, quo vadis? A historical perspective from a coordination chemist viewpoint☆

J Ferrando-Soria, J Vallejo, M Castellano… - Coordination Chemistry …, 2017 - Elsevier
Molecular magnetism has travelled a long way from the pioneering studies on electron
exchange and double exchange or spin crossover and valence tautomerism in small …

Metallosupramolecular approach toward multifunctional magnetic devices for molecular spintronics

M Castellano, R Ruiz-Garcia, J Cano… - Coordination Chemistry …, 2015 - Elsevier
The work presented in this review constitutes a successful extension of our group's research
on the chemistry and physics of dinuclear copper (II) metallacyclophanes with aromatic …

Exchange Coupling in Carboxylato‐Bridged Dinuclear Copper(II) Compounds: A Density Functional Study

A Rodríguez‐Fortea, P Alemany… - … –A European Journal, 2001 - Wiley Online Library
A computational study of the exchange coupling is presented for a selected sample of
carboxylato‐bridged dinuclear copper (ii) compounds. Model calculations have been used …

A unified view of the theoretical description of magnetic coupling in molecular chemistry and solid state physics

I de PR Moreira, F Illas - Physical Chemistry Chemical Physics, 2006 - pubs.rsc.org
The magnetic interactions in organic diradicals, dinuclear inorganic complexes and ionic
solids are presented from a unified point of view. Effective Hamiltonian theory is revised to …

Broken-symmetry density functional theory investigation on bis-nitronyl nitroxide diradicals: influence of length and aromaticity of couplers

ME Ali, SN Datta - The Journal of Physical Chemistry A, 2006 - ACS Publications
A series of nitronyl nitroxide (NN) diradicals with linear conjugated couplers and another
series with aromatic couplers have been investigated by the broken-symmetry (BS) DFT …

Targeted Ferromagnetic Coupling in a Trinuclear Copper(II) Complex:  Analysis of the St = 3/2 Spin Ground State

T Glaser, M Heidemeier, S Grimme, E Bill - Inorganic chemistry, 2004 - ACS Publications
The trinuclear CuII complex [(talen) CuII3](1) using the new triplesalen ligand H6talen has
been synthesized and structurally characterized. The three CuII ions are bridged in am …

Trinuclear Copper Complexes with Triplesalen Ligands: Geometric and Electronic Effects on Ferromagnetic Coupling via the Spin‐Polarization Mechanism

T Glaser, M Heidemeier… - … A European Journal, 2007 - Wiley Online Library
A series of trinuclear CuII complexes with the tris (tetradentate) triplesalen ligands H6talen,
H6talen, and H6talen, namely [(talen) CuII3](1),[(talen) CuII3](2), and [(talen) CuII3](3), were …

[LIVRE][B] Theoretical and computational aspects of magnetic organic molecules

SN Datta, CO Trindle, F Illas - 2013 - books.google.com
Organic materials with extraordinary magnetic properties promise a wide range of light,
flexible, and inexpensive alternatives to familiar metal-based magnets. Individual organic …

Systematic approach to design organic magnetic molecules: strongly coupled diradicals with ethylene coupler

KC Ko, D Cho, JY Lee - The Journal of Physical Chemistry A, 2012 - ACS Publications
The intramolecular magnetic coupling constant (J) values of diradical systems linked with
two monoradicals through a coupler (para-substituted phenyl acetylene (Model I), meta …

Density functional theory based study of magnetic interaction in bis-oxoverdazyl diradicals connected by different aromatic couplers

D Bhattacharya, A Misra - The Journal of Physical Chemistry A, 2009 - ACS Publications
We design and investigate 11 different bis-oxoverdazyl diradicals connected by various
aromatic couplers for their magnetic properties. The intramolecular magnetic exchange …