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Stability and electronic structure of InN nanotubes from first-principles study

Stability and electronic structure of InN nanotubes from first-principles study
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摘要 The stability and electronic structure of hypothetical InN nanotubes were studied by first-principles density functional theory. It, was found that the strain energies of InN nanotubes are smaller than those of carbon nanotubes of the same radius. Single-wall zigzag InN nanotubes were found to be semiconductors with a direct band gap while the armchair counterparts have an indirect band gap. The band gaps of nanotubes decrease with increasing diameter, similar to the case of carbon nanotubes. The stability and electronic structure of hypothetical InN nanotubes were studied by first-principles density functional theory. It, was found that the strain energies of InN nanotubes are smaller than those of carbon nanotubes of the same radius. Single-wall zigzag InN nanotubes were found to be semiconductors with a direct band gap while the armchair counterparts have an indirect band gap. The band gaps of nanotubes decrease with increasing diameter, similar to the case of carbon nanotubes.
作者 陈丽娟
出处 《Chinese Physics B》 SCIE EI CAS CSCD 2006年第4期798-801,共4页 中国物理B(英文版)
关键词 INN strain energies band gap first-principles calculation InN, strain energies, band gap, first-principles calculation
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