Published 1986 | Version v1
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Theoretical studies of defects in binary and ternary oxides

Description

This paper presents some preliminary results of electronic structure of substitutional defects and vacancy in binary and ternary cubic zirconium oxides obtained by the embedded molecular-cluster model calculation. The importance of electronic charge redistribution in the solids where the defect is introduced into the perfect lattice is highlighted and the effect of electron polarization of the surrounding ions of the defect discussed

Availability note (English)

MF available from INIS under the Report Number; Available from NTIS, PC A02/MF A01; 1 as DE87004704.

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Additional details

Publishing Information

Imprint Pagination
7 p.
Report number
CONF-861207--62

Conference

Title
Materials Research Society fall meeting.
Dates
1-5 Dec 1986.
Place
Boston, MA (USA).

INIS

Country of Publication
United States
Country of Input or Organization
United States
INIS RN
18064463
Subject category
S36: MATERIALS SCIENCE; S75: CONDENSED MATTER PHYSICS, SUPERCONDUCTIVITY AND SUPERFLUIDITY;
Resource subtype / Literary indicator
Conference
Descriptors DEI
CHARGE TRANSPORT; CRYSTAL DEFECTS; CUBIC LATTICES; ELECTRONIC STRUCTURE; ENERGY GAP; SOLID CLUSTERS; VACANCIES; ZIRCONIUM OXIDES
Descriptors DEC
CHALCOGENIDES; CRYSTAL LATTICES; CRYSTAL STRUCTURE; OXIDES; OXYGEN COMPOUNDS; POINT DEFECTS; TRANSITION ELEMENT COMPOUNDS; ZIRCONIUM COMPOUNDS

Optional Information

Notes
Portions of this document are illegible in microfiche products.