The electronic structure of eleven crystalline nickel oxides was investigated by band theory - CNDO method. Both the band and local properties of the electronic structure were calculated and were used for the description of chemical bonding in Ni(II) (NiO, Li2NiO2, Na2NiO2, K2NiO2, BaNiO2, La2NiO4), Ni(III) (LiNiO2, NaNiO2, LaNiO3) and Ni(IV) (BaNiO3) compounds.

Original languageEnglish
Pages (from-to)555-563
Number of pages9
JournalJournal of Electron Spectroscopy and Related Phenomena
Volume68
Issue numberC
DOIs
StatePublished - 6 May 1994

    Scopus subject areas

  • Electronic, Optical and Magnetic Materials
  • Radiation
  • Atomic and Molecular Physics, and Optics
  • Condensed Matter Physics
  • Spectroscopy
  • Physical and Theoretical Chemistry

ID: 49961171