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• W2039202213 abstract "On basis of the first principle calculation we show that a crystalline structure of silicon, as a novel allotrope with nanotubular holes along two perpendicular directions, is stable. The calculations on geometrical and electronic properties reveal that this allotrope possesses a direct band gap wider by 0.5 eV than the indirect one of silicon with diamond structure. The crystal belongs to I41/AMD space group, showing anisotropic optical properties and Young modulus. The bulk modulus is 64.4 GPa and the density is 1.9 g/cm3, lower than that of the diamond silicon due to the presence of nanotubular holes. It is hopeful that the allotrope may widely expand applications of silicon in many fields due to its direct band gap and specific nanotubular structure." @default.
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• W2039202213 date "2015-06-01" @default.
• W2039202213 modified "2023-10-11" @default.
• W2039202213 title "Stable porous crystalline silicon with nanotubular structure: A predicted allotrope with direct band gap" @default.
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• W2039202213 doi "https://doi.org/10.1016/j.physb.2015.03.027" @default.
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