6 research outputs found
Strong Exchange Couplings Drastically Slow Down Magnetization Relaxation in an Air‐Stable Cobalt(II)‐Radical Single‐Molecule Magnet (SMM)
The energy barrier leading to magnetic bistability in molecular clusters is determined by the magnetic anisotropy of the cluster constituents. By incorporating a highly anisotropic four‐coordinate cobalt(II) building block into a strongly coupled fully air‐ and moisture‐stable three‐spin system, it proved possible to suppress under‐barrier Raman processes leading to 350‐fold increase of magnetization relaxation time and pronounced hysteresis. Relaxation times of up to 9 hours at low temperatures were found
Improving the speed and accuracy of ab initio calculations of the electronic structure of metal complexes
This thesis describes the development and application of new quantum chemical methods for the fast and accurate numerical simulation of the electronic structure and the magnetic and spectroscopic properties of metal complexes, with a focus on molecular nanomagnets
Exchange coupling and single molecule magnetism in redox-active tetraoxolene-bridged dilanthanide complexes
10.1039/c7sc04873dCHEMICAL SCIENCE951221-123