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Theoretical investigations of the physical properties of zircon-type YVO4

โœ Scribed by Zuocai Huang; Jing Feng; Wei Pan

Book ID
113758491
Publisher
Elsevier Science
Year
2012
Tongue
English
Weight
986 KB
Volume
185
Category
Article
ISSN
0022-4596

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Theoretical investigations of the physic
Theoretical investigations of the physical properties of tetragonal CaSiO3 perovskite
โœ Zi-Jiang Liu; Su-Qing Duan; Jun Yan; Xiao-Wei Sun; Cai-Rong Zhang; Yan-Dong Chu ๐Ÿ“‚ Article ๐Ÿ“… 2010 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 435 KB

The first principles study of the physical properties of tetragonal CaSiO 3 perovskite is reported using the pseudopotential plane wave method within the local density approximation. The calculated equilibrium volume is in good agreement with the available experimental data. A complete elastic tenso