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The structural and electronic properties of type-I clathrates Ba8CuxGa16−xSn30from first-principle calculations

✍ Scribed by D. C. Li, L. Fang, S. K. Deng, K. Y. Kang, W. H. Wei, H. B. Ruan


Book ID
113108258
Publisher
Springer-Verlag
Year
2012
Tongue
English
Weight
437 KB
Volume
86
Category
Article
ISSN
0019-5480

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Synthesis and first-principles calculati
✍ D. C. Li; L. Fang; S. K. Deng; K. Y. Kang; W. H. Wei; H. B. Ruan 📂 Article 📅 2012 🏛 John Wiley and Sons 🌐 English ⚖ 744 KB

## Abstract In the present work we report on the synthesis of type‐I clathrates Sr~8~Ga~16~Sn~__x__~Ge~30 − __x__~ (0 ≤ __x__ ≤ 12). To find out how the substitution of Sn for Ge affects structural stability and electronic structure, the structural and electronic properties for Sr~8~Ga~16~Sn~__x__~

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