Structural dependence of threshold displacement energies in rutile, anatase and brookite TiO2

Systematic molecular dynamics simulations of low energy cascades have been performed to examine how threshold displacement events are effected by changes in crystal structure. Exploiting the structural proximity of the rutile, anatase and brookite polymorphs of TiO2, a quantitative examination of de...

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Bibliographic Details

Published in:	Materials chemistry and physics Vol. 147; no. 1-2; pp. 311 - 318
Main Authors:	Robinson, M., Marks, N.A., Lumpkin, G.R.
Format:	Journal Article
Language:	English
Published:	Elsevier B.V 15.09.2014
Subjects:	Computer modelling and simulation Microstructure Oxides Radiation damage Oxides Computer modelling and simulation Microstructure Radiation damage
ISSN:	0254-0584, 1879-3312
Online Access:	Get full text
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