The Electronic Structure of Crystalline Lead Oxides: II. Chemical Bonding in the Crystalline Lead Oxides

Forskningsoutput: TidskriftsbidragArtikel i vetenskaplig tidskrift

Abstract

A quantum‐chemical definition is proposed of the full atomic valence taking into account both, covalent and ionic components of chemical bonds formed by an atom in molecules or crystals. Atomic charges, covalent bond orders, and full atomic valencies of lead and oxygen atoms in the crystalline lead oxides are calculated in the framework of the LUC‐CNDO approach.

Detaljer

Författare
Externa organisationer
  • Saint Petersburg State University
Forskningsområden

Ämnesklassifikation (UKÄ) – OBLIGATORISK

  • Teoretisk kemi
Originalspråkengelska
Sidor (från-till)411-418
Antal sidor8
Tidskriftphysica status solidi (b)
Volym165
Utgivningsnummer2
StatusPublished - 1991 jan 1
PublikationskategoriForskning
Peer review utfördJa
Externt publiceradJa