Phase diagram of ZrSiRu2 with Orb v3 conservative inf MPA; e_above_hull: 38.098244 eV/atom; predicted_stable: False
Ru2ZrSi L21 full-Heusler
L21 full-Heusler Ru2ZrSi, Fm-3m, a=5.98 Å. Conventional cell with 16 atoms. Predicted zT>1 via co-substitution (two-band model, Garmroudi et al. 2026).
Created by route
Calculate energy above the convex hull