First-principles study of ternary fcc solution phases from special quasirandom structures

Dongwon Shin, Axel van de Walle, Yi Wang +1

In the present work, ternary Special Quasirandom Structures (SQSs) for a fcc solid solution phase are generated at different compositions, $x_A=x_B=x_C=\frac{1}{3}$ and $x_A=\tfra…