Combined Experimental and Ab Initio Methods for Rationalization of Magneto-Luminescent Properties of Yb<sup>III</sup> Nanomagnets Embedded in Cyanido/Thiocyanidometallate-Based Crystals
Jakub J. Zakrzewski, Kunal Kumar, Mikołaj Żychowicz, Robert Jankowski, Maciej Wyczesany, Barbara Sieklucka, Shin‐ichi Ohkoshi, Szymon Chorąży
Abstract
series. This trend partially follows the magnetic axiality, being deeper correlated with the phonon modes schemes of (thio)cyanido matrices.
Topics & Concepts
ChemistryAb initioAb initio quantum chemistry methodsExcited stateAtomic physicsMoleculePhysicsOrganic chemistryMagnetism in coordination complexesLanthanide and Transition Metal ComplexesElectron Spin Resonance Studies