A comparative study for structural and electronic properties of single-crystal ScN

R. Mohammad, S. Katircioglu

A comparative study by FP-LAPW calculations based on DFT within LDA, PBE-GGA, EV${}_{ex}$-PW${}_{co}$-GGA, and EV${}_{ex}$-GGA-LDA${}_{co}$ schemes is introduced for the structural and ele…