Phase diagram of LiFe6As5 with Orb v3 conservative inf MPA; e_above_hull: 0.179302 eV/atom; predicted_stable: False
LiFe6As5 (P1) 1
LiFe6As5 (requested SG: P63/mmc #194, calculated: P1 #1, optimized: 400 steps, cell relaxed, symmetry refined)
Created by route
Calculate energy above the convex hull