Multiple scattering method applied to the electronic structure and spectra of the impurity ions Cu2+, Ni2+, Co2+, Fe2+ and their tetrahedral environments in ZnO, ZnS and CdS

✍ Scribed by Manoel L. de Siqueira; Sven Larsson

• Publisher: Elsevier Science
• Year: 1975
• Tongue: English
• Weight: 472 KB
• Volume: 32
• Category: Article
• ISSN: 0009-2614
• DOI: 10.1016/0009-2614(75)85144-x

✦ Synopsis

The multiple scattering method with local exchange and muff&in potentials is applied to tetrahedral clusters with Cuz+ Ni** , Coz+ and Fez+ as central ions and oxygen and sulphlir as ligands. The calc&ted orbital enerm differences e (t3)'-E(c*) YC compared to At values deduced from optical spectra. The agreement is fairly good.