عنوان مقاله English
In this paper, we studied the compound structure properties such as lattice constant, bulk module, compressibility, volume optimization in CaCl2 phase of SnO2 ceramic. Calculations were made with using a Full Potential-Linearized Augmented Plane Wave (FP-LAPW) method, in the framework Density Functional Theory(DFT)with different approximations and by using WIEN2k package. The obtained results are in a good agreement with the other results.
کلیدواژهها English
