First-principles study to probe the effect of substitution at X and Z sites on the electronic, magnetic and transport properties of Co2X (V, Nb, Ta) Z (Al, Ga, In, Si, Ge, Sn) …
R Dutt, A Chakrabarti - Solid State Communications, 2023 - Elsevier
In the present work, we have used density functional theory based electronic structure
calculations to probe the role of isovalent substitution at X@(0.5, 0.5, 0.5) and Z@(0, 0, 0) …
calculations to probe the role of isovalent substitution at X@(0.5, 0.5, 0.5) and Z@(0, 0, 0) …