Topological analysis of electrostatic potential in SrTiO3

E. A. Zhurova, J. M. Zuo, V. G. Tsirelson

Research output: Contribution to journalArticle

Abstract

The topological analysis of the electrostatic potential distribution of SrTiO3 calculated from the experimental and theoretical electron densities was performed. It was found that the electrostatic potential and the electron density fields in SrTiO3 had different sets of the critical points. The topological features of the electrostatic potential lead to the explicit picture of Coulomb force field, showing that the Coulomb interactions are transmitted through a crystal in the form of the 'atom-atom interactions', a network of which is a specific property of each compound.

Original languageEnglish (US)
Pages (from-to)2143-2146
Number of pages4
JournalJournal of Physics and Chemistry of Solids
Volume62
Issue number12
DOIs
StatePublished - Dec 1 2001

Keywords

  • A. Inorganic compounds

ASJC Scopus subject areas

  • Electronic, Optical and Magnetic Materials
  • Condensed Matter Physics

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