Phase diagram of Ba2Ti2Fe2As4O with Orb v3 conservative inf MPA; e_above_hull: 0.013608 eV/atom; predicted_stable: True
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -72.1765 eV; energy change = -0.9781 eV; symmetry: I4/mmm → I4/mmm