Pressure-driven structural phase transition unlocks multifunctionality in KMgX (X = P, As, Sb, and Bi) compounds: A first-principles study

The search for materials with multifunctional properties has attracted significant attention due to their potential applications in various energy-related devices.

The search for materials with multifunctional properties has attracted significant attention due to their potential applications in various energy-related devices. Pressure-induced phase transitions provide an effective strategy for accessing different structural phases of a…