Novel potentials for modelling defect formation and oxygen vacancy migration in Gd2Ti2O7 and Gd2Zr2O7 pyrochlores

Ceramic materials play a critical role in the safe long-term immobilisation of nuclear waste and fundamental understanding of both radiation damage and healing processes are required in order to determine the suitability of proposed storage materials, such as pyrochlores. Here, new interatomic poten...

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Veröffentlicht in:	Journal of materials chemistry 2012-01, Vol.22 (11), p.4675-468
Hauptverfasser:	Gunn, David S. D, Allan, Neil L, Foxhall, Henry, Harding, John H, Purton, John A, Smith, W, Stein, Michael J, Todorov, Ilian T, Travis, Karl P
Format:	Artikel
Sprache:	eng
Online-Zugang:	Volltext
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