Phase diagram of CaFePF with Orb v3 conservative inf MPA; e_above_hull: 1.048751 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -43.1480 eV; energy change = -0.1518 eV; symmetry: P4/nmm → P4/nmm