Impact of isovalent and aliovalent substitution on the mechanical and thermal properties of Gd2Zr2O7

Abstract In this study, a density functional theory method is employed to investigate the effects of isovalent and aliovalent substitution of Sm3+ on the phase stability, thermo-physical properties and electronic structure of Gd2Zr2O7. It is shown that the isovalent substitution of Sm3+ for Gd3+ res...

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Bibliographic Details
Main Authors: S. Zhang, H. B. Zhang, F. A. Zhao, M. Jiang, H. Y. Xiao, Z. J. Liu, X. T. Zu
Format: article
Language:EN
Published: Nature Portfolio 2017
Subjects:
R
Q
Online Access:https://doaj.org/article/5a198d5a93b04dee95baf98f74b16f1b
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