In this study, Zintl phased tetrapotassium diarsenidozincate K4ZnAs2 semiconductor compound was analysed using ab initio methods for structural, electronic, mechanical, elastic, and optical properties using six exchange ...

A Zintl-phased K3Ag3As2 ternary compound previously not studied using ab initio techniques was analysed for its structural, electronic, mechanical, elastic, and optical properties using LDA-PZ, GGA-EV, GGA-PBE, GGA-PBESol, ...