Stress Concentration in the Bulk Cr2O3: Effects of Temperature and Point Defects

Modeling the growth and failure of passive oxide films formed on stainless steels is of general interest for the use of stainless steel as structural material and of special interest in the context of life time extension of light water reactors in nuclear power plants. Using the DFT+U approach, a th...

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Bibliographic Details
Main Authors: Mazharul M. Islam, Thierry Couvant, Philippe Marcus, Boubakar Diawara
Format: Article
Language:English
Published: Hindawi Limited 2017-01-01
Series:Journal of Chemistry
Online Access:http://dx.doi.org/10.1155/2017/7039436