Phase diagram of LiFe6As5 with Orb v3 conservative inf MPA; e_above_hull: 0.100267 eV/atom; predicted_stable: False
template-LiFe6As5 10 - relaxed
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -155.0694 eV; energy change = -1.0791 eV; symmetry: R-3m → R32
Created by route
Calculate energy above the convex hull