Phase diagram of FeCoSiP with Orb v3 conservative inf MPA; e_above_hull: 0.893796 eV/atom; predicted_stable: False
FeCoPSi (FeCoSiP, 4 sites) — GPSK-300 - relaxed
Cell + Ionic relaxation with CHGNet; 0.03 eV/Å threshold; final energy = -26.2647 eV; energy change = -1.2213 eV; symmetry: P2/m → P2/m
One more layer on this: mmoderwell ran the CHGNet-relaxed FeCoPSi through the convex hull ...
Created by route
Calculate energy above the convex hull