Phase diagram of NiPbO3 with Orb v3 conservative inf MPA; e_above_hull: 0.173555 eV/atom; predicted_stable: False
Created by route
Calculate energy above the convex hull
template-NiPbO3 1 - relaxed
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -51.8989 eV; energy change = -0.1088 eV; symmetry: R3c → R3c