Phase diagram of AlCr3Fe3As2 with Orb v3 conservative inf MPA; e_above_hull: 0.208477 eV/atom; predicted_stable: False
AlCr3Fe3As2 (P1)
AlCr3Fe3As2 (requested SG: I4/mmm #139, calculated: P1 #1, optimized: 400 steps, cell relaxed, symmetry refined)
Created by route
Calculate energy above the convex hull