Phase diagram of LiV3(SF3)2 with Orb v3 conservative inf MPA; e_above_hull: 0.391722 eV/atom; predicted_stable: False
Created by route
Calculate energy above the convex hull
template-LiV3(SF3)2 1 - relaxed
Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -69.6063 eV; energy change = -9.1182 eV; symmetry: P-3m1 → P-3m1