Phase diagram of CaFe4S9 with Orb v3 conservative inf MPA; e_above_hull: 0.368267 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -156.4195 eV; energy change = -28.0093 eV; symmetry: P4/n → P4/n