Phase diagram of Fe(CuN)3 with Orb v3 conservative inf MPA; e_above_hull: 0.484719 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -85.1015 eV; energy change = -1.2393 eV; symmetry: P63/m → P63/m