$\text{Ab-initio}$ study of $\text{A}Bi{O}_3$ ($A$=Ba, Sr, Ca) under high pressure

Andriy Smolyanyuk, Cesare Franchini, Lilia Boeri

Using $\text{ab-initio}$ crystal structure prediction we study the high-pressure phase diagram of $\text{A}Bi{O}_3$ bismuthates ($A$=Ba, Sr, Ca) in a pressure range up to 100 G…