The electronic structure of crystalline nickel oxides

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Abstract

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.

Detaljer

Författare
Externa organisationer
  • Saint Petersburg State University
Forskningsområden

Ämnesklassifikation (UKÄ) – OBLIGATORISK

  • Teoretisk kemi
Originalspråkengelska
Sidor (från-till)555-563
Antal sidor9
TidskriftJournal of Electron Spectroscopy and Related Phenomena
Volym68
Utgåva nummerC
StatusPublished - 1994 maj 6
PublikationskategoriForskning
Peer review utfördJa
Externt publiceradJa