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Title: Electronic structure of the cubic phase of zirconium dioxide

Abstract

Zirconium dioxide ZrO{sub 2} is of considerable practical interest as an optical material with a high refraction index, a high-temperature solid electrolyte, and constructional ceramics. As all these properties are due to the electronic subsystem of this compound, it is of interest to study its electronic structure. The band structure of the cubic phase of zirconium dioxide is obtained by employing the LMTO method. Its PV-diagram is calculated to determine the equilibrium lattice constant. The emission ZrL{sub III}-spectrum of this compound is interpreted.

Authors:
; ;  [1]
  1. Institute of Metallophysics, Kiev (Ukraine)
Publication Date:
Sponsoring Org.:
USDOE
OSTI Identifier:
147127
Resource Type:
Journal Article
Journal Name:
Journal of Structural Chemistry
Additional Journal Information:
Journal Volume: 34; Journal Issue: 5; Other Information: PBD: Mar 1994; TN: Translated from Zhurnal Strukturnoi Khimii; 34: No. 5, 57-62(Sep-Oct 1993)
Country of Publication:
United States
Language:
English
Subject:
40 CHEMISTRY; 36 MATERIALS SCIENCE; ZIRCONIUM OXIDES; ELECTRONIC STRUCTURE; CUBIC LATTICES; BAND THEORY; MATHEMATICAL MODELS; LATTICE PARAMETERS; X-RAY SPECTROSCOPY

Citation Formats

Krasovskii, A.E., Katashinskii, A.S., and Parkhomenko, N.V.. Electronic structure of the cubic phase of zirconium dioxide. United States: N. p., 1994. Web. doi:10.1007/BF00753570.
Krasovskii, A.E., Katashinskii, A.S., & Parkhomenko, N.V.. Electronic structure of the cubic phase of zirconium dioxide. United States. doi:10.1007/BF00753570.
Krasovskii, A.E., Katashinskii, A.S., and Parkhomenko, N.V.. Tue . "Electronic structure of the cubic phase of zirconium dioxide". United States. doi:10.1007/BF00753570.
@article{osti_147127,
title = {Electronic structure of the cubic phase of zirconium dioxide},
author = {Krasovskii, A.E. and Katashinskii, A.S. and Parkhomenko, N.V.},
abstractNote = {Zirconium dioxide ZrO{sub 2} is of considerable practical interest as an optical material with a high refraction index, a high-temperature solid electrolyte, and constructional ceramics. As all these properties are due to the electronic subsystem of this compound, it is of interest to study its electronic structure. The band structure of the cubic phase of zirconium dioxide is obtained by employing the LMTO method. Its PV-diagram is calculated to determine the equilibrium lattice constant. The emission ZrL{sub III}-spectrum of this compound is interpreted.},
doi = {10.1007/BF00753570},
journal = {Journal of Structural Chemistry},
number = 5,
volume = 34,
place = {United States},
year = {1994},
month = {3}
}