First-principles study of halide double perovskite Rb2GeNiCl6: a stable magnetic semiconductor for spintronic and thermoelectric applications
In this systematic report, ab initio simulations based on density functional theory (DFT) have been performed to examine the structural and elastic stability, electronic profile, and transport properties of Rb2GeNiCl6 double halide perovskites. The structural optimization, evaluation of mechanical stability criteria, a...