Phase diagram of Mn2HgO4 with Orb v3 conservative inf MPA; e_above_hull: 0.014592 eV/atom; predicted_stable: True
Created by route
Calculate energy above the convex hull
template-Mn2HgO4 - relaxed
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -86.9972 eV; energy change = -0.2122 eV; symmetry: I41/amd → I41/amd