Fe(ii) complex with the octadentate btpa ligand: a DFT study on a spin-crossover system that reveals two distinct high-spin states

Juliusz A. Wolny, Hauke Paulsen, John J. McGarvey, Rolf Diller, Volker Schünemann, Hans Toftlund
  • Physical Chemistry Chemical Physics, January 2009, Royal Society of Chemistry
  • DOI: 10.1039/b905328j