Phase diagram of ZrFe2 with Orb v3 conservative inf MPA; e_above_hull: 0.003346 eV/atom; predicted_stable: True
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -210.3514 eV; energy change = -0.1114 eV; symmetry: P63/mmc → P63/mmc