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DFT-Based Calculations of the Structural Stability, Electronic and Elastic Characteristics of BBi1-xSbx Ternary Ordered Alloys
The structural, phase stability, elastic and electronic properties of Sb-doped BBi have been systematically investigated in the zinc blende phase by means of the first-principle approach based on the density f...
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Article
First-principles computations of \(\hbox {Y}_{x}\hbox {Ga}_{1-{x}}\) As-ternary alloys: a study on structural, electronic, optical and elastic properties
In this work, the first-principles computational study on the structural, elastic, electronic and optical properties of $$\hbox {Y}_{x}\hbox {...