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Electronic Structures and Optoelectronic Properties of C/Ge-doped Silicon Nanotubes
2015
Journal of Inorganic Materials
The electronic structures and optoelectronic properties of C/Ge-doped single-walled armchair silicon nanotubes were determined by using first-principles calculations in the framework of density-functional theory. In particular, the calculated results indicate that both pure and C/Ge-doped silicon nanotubes display a direct band gap. The band gap is decreased firstly and then increased for the silicon nanotubes doped with C and Ge, respectively. Moreover, the upper of valence band is mainly
doi:10.15541/jim20140439
fatcat:ppow5fiaa5ekresrsue7klcpyu