Magnetochemistry

Magnetic susceptibility-temperature relation

These studies are extensive cooperations with inorganic experimentalists. The theoretical part includes fitting of the magnetic susceptibility-temperature relation to the Van Vleck equation by using the Heisenberg model and broken-symmetry quantum chemistry calculations. (Dalton. Trans., 18, 1838, 2007; CrystEngComm, 8, 384, 2006; Inorg. Chim. Acta. 360, 1645, 2007)