In this work, the structure and density of state of α-Al2O3 were theoretically investigated. The calculations have been performed using a Full Potential-Linearized Augmented Plane Wave (FP-LAPW) method in the framework of Density Functional Theory (DFT) whit various approximations using WIEN2k package. The calculated band structure shows a direct band gap 6.3eV at the point in the Brillouin zone. The calculated band structure is in good agreement with theoretical and experimental results.
. (2010). Determination of the Electronic Structure of α-Al2O3 with First Principle Study. Journal of Advanced Materials and Technologies, -1(2*), 145-150. doi: 10.30501/jamt.2010.70194
MLA
. "Determination of the Electronic Structure of α-Al2O3 with First Principle Study", Journal of Advanced Materials and Technologies, -1, 2*, 2010, 145-150. doi: 10.30501/jamt.2010.70194
HARVARD
. (2010). 'Determination of the Electronic Structure of α-Al2O3 with First Principle Study', Journal of Advanced Materials and Technologies, -1(2*), pp. 145-150. doi: 10.30501/jamt.2010.70194
CHICAGO
, "Determination of the Electronic Structure of α-Al2O3 with First Principle Study," Journal of Advanced Materials and Technologies, -1 2* (2010): 145-150, doi: 10.30501/jamt.2010.70194
VANCOUVER
. Determination of the Electronic Structure of α-Al2O3 with First Principle Study. J. Adv. Mater. Technol.. 2010;-1(2*):145-150 (In Persian). doi: 10.30501/jamt.2010.70194
