Phase diagram of CsNiBr3 with Orb v3 conservative inf MPA; e_above_hull: 0.000083 eV/atom; predicted_stable: True
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -32.6876 eV; energy change = -0.0236 eV; symmetry: P63/mmc → P63/mmc