One of the key factors behind the rapid evolution of molecular spintronics is the efficient
realization of spin manipulation of organic molecules with a magnetic center. The spin state …

To realize molecular spintronic devices, it is important to externally control the magnetization
of a molecular magnet. One class of materials particularly promising as building blocks for …

Porphyrin molecules are particularly interesting candidates for spintronic applications due to
their bonding flexibility, which allows to modify their properties substantially by the addition …

We have investigated computationally the magnetic spin state of free metalloporphyrins and
how magnetic ordering in metalloporphyrins can be induced through contact with the …

The coupling mechanism of magnetic molecules to ferromagnetic surfaces is of scientific
interest to design and tune molecular spintronic interfaces utilizing their molecular and …

We report, on the basis of density-functional theory+ U (DFT+ U) calculations that
metalloporphyrins can adsorb on ferromagnetic metal surfaces in two distinct configurations …

Paramagnetic transition-metal complexes assembled on surfaces are of great interest for
potential applications in organic spintronics. The magnetochemical interactions of the spin of …

We demonstrate by means of X-ray magnetic circular dichroism that the magnetization of
paramagnetic Fe-octaethylporphyrin (FeOEP) molecules coupled antiferromagnetically to an …

Systematic density functional theory calculations that treat the strong on-site 3d electron–
electron interactions on iron via a Hubbard U eff= 3.0 eV and the van der Waals (vdW) …

Spin switching of organometallic complexes by ferromagnetic surfaces is an important topic
in the area of molecular nanospintronics. Moreover, graphene has been shown as a 2D …