Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -81.9826 eV; energy change = -62.8070 eV; symmetry: I4/mmm → P1
Crystal structure generated by TreeQuest optimization (file 5)
Phase diagram of FeCo2Si2B; e_above_hull: 0.401651 eV/atom; predicted_stable: False