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First-principles calculations for electronic, optical and thermodynamic properties of ZnS

โœ Scribed by Cui-E, Hu; Zhao-Yi, Zeng; Yan, Cheng; Xiang-Rong, Chen; Ling-Cang, Cai


Book ID
120639805
Publisher
IOP Publishing
Year
2008
Tongue
English
Weight
297 KB
Volume
17
Category
Article
ISSN
1674-1056

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Electronic and optical properties of CuG
โœ Bin Xu; Xingfu Li; Zhen Qin; Congguo Long; Dapeng Yang; Jinfeng Sun; Lin Yi ๐Ÿ“‚ Article ๐Ÿ“… 2011 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 593 KB

Electronic structure and optical properties of CuGaS 2 are calculated using the full potential linearized augmented plane wave plus local orbitals method. The calculated equilibrium lattice is in reasonable agreement with the experimental data. The electronic structures indicate that CuGaS 2 is a se