Phase diagram of Fe3Au with Orb v3 conservative inf MPA; e_above_hull: 0.126671 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -28.0560 eV; energy change = -0.0021 eV; symmetry: I4/mmm → I4/mmm