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Elastic properties of tetragonal BiFeO3 from first-principles calculations

โœ Scribed by Dong, Huafeng; Chen, Changqing; Wang, Shanying; Duan, Wenhui; Li, Jingbo


Book ID
120347215
Publisher
American Institute of Physics
Year
2013
Tongue
English
Weight
877 KB
Volume
102
Category
Article
ISSN
0003-6951

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Elastic properties of cubic perovskite B
โœ De-Ming Han; Xiao-Juan Liu; Shu-Hui Lv; Hong-Ping Li; Jian Meng ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 198 KB

We present first-principles investigations on the structural and elastic properties of the cubic perovskite BaRuO 3 using density-functional theory within both local density approximation (LDA) and generalized gradient approximation (GGA). Basic physical properties, such as lattice constant, shear m