The Prediction of Lattice Constants in Orthorhombic Perovskites

Rick Ubic, G. Subodh

Research output: Contribution to journalArticlepeer-review

Abstract

The correlation between ionic radii and the lattice constants of orthorhombic perovskites is examined and new empirical formulae for the relationship are derived. As for cubic/pseudocubic perovskites, the lattice constants are largely a function of A–X and B–X bond lengths rather than ionic charge. The average absolute relative error in the predicted a , b , and c lattice constants so derived is expected to be about 0.616%, 1.089%, and 0.714%, respectively; therefore, these formulae are in better agreement with experimental data than those derived by earlier researchers.

Original languageAmerican English
JournalJournal of Alloys and Compounds
StatePublished - 20 Nov 2009

Keywords

  • ceramics
  • crystal structure
  • ferroelectrics

EGS Disciplines

  • Materials Science and Engineering

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