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Stability and electronic structure of AlN nanotubes

✍ Scribed by Zhao, Mingwen; Xia, Yueyuan; Zhang, Dongju; Mei, Liangmo


Book ID
121216709
Publisher
The American Physical Society
Year
2003
Tongue
English
Weight
153 KB
Volume
68
Category
Article
ISSN
1098-0121

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Using multireference configuration-interaction methods and double to triple-zeta basis sets with semidiffuse and polarization functions, potential energies and spectroscopic constants for low-lying doublet, and quartet states of AlN Γ€ were calculated. X 2 R ΓΎ has R e ΒΌ 3:280 bohr and x e ΒΌ 870 cm Γ€1