We investigated the effect of aluminum vacancies (V Al ) on the structural, electronic and optical properties of Ta 4 Al 1 Γ x C 3 (x ΒΌ0, 0.25, 0.5, 0.75) based on the first-principle calculation using density functional theory. We found that the lattice constant a remains almost unchanged with the
β¦ LIBER β¦
First-principles investigations on elastic properties of - and - Ta4AlC3
β Scribed by X.H. Deng; B.B. Fan; W. Lu
- Publisher
- Elsevier Science
- Year
- 2009
- Tongue
- English
- Weight
- 970 KB
- Volume
- 149
- Category
- Article
- ISSN
- 0038-1098
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