Phase diagram of LiFeF6 with Orb v3 conservative inf MPA; e_above_hull: 0.053289 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -68.3758 eV; energy change = -0.3740 eV; symmetry: P42nm → P42nm