Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -57.2022 eV; energy change = 1.6006 eV; symmetry: I4/mmm → I4/mmm
Crystal structure generated by TreeQuest optimization (file 14)
Phase diagram of Al(FeB)2; e_above_hull: 1.458018 eV/atom; predicted_stable: False