Oxygen self-diffusion mechanisms in monoclinic

In this work, we quantify oxygen self-diffusion in monoclinic-phase zirconium oxide as a function of temperature and oxygen partial pressure. A migration barrier of each type of oxygen defect was obtained by first-principles calculations. Random walk theory was used to quantify the diffusivities of...

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Bibliographic Details
Main Authors: Yang, Jing (Contributor), Youssef, Mostafa Youssef Mahmoud (Contributor), Yildiz, Bilge (Contributor)
Other Authors: Massachusetts Institute of Technology. Department of Materials Science and Engineering (Contributor), Massachusetts Institute of Technology. Laboratory for Nuclear Science (Contributor)
Format: Article
Language:English
Published: American Physical Society, 2018-03-29T17:45:43Z.
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