Phase diagram of Zr3TiMn8 with Orb v3 conservative inf MPA; e_above_hull: 0.005912 eV/atom; predicted_stable: True
Created by route
Calculate energy above the convex hull
template-Zr3TiMn8 - relaxed
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -109.1482 eV; energy change = -0.0032 eV; symmetry: P3m1 → P3m1