Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -31.6740 eV; energy change = 0.0000 eV; symmetry: Pmmm → Pmmm
Fe2NiZr (space group: Pmmm #47, crystal system: orthorhombic, point group: mmm) (missed expected composition: Fe2NiZr)
Phase diagram of ZrFe2Ni; e_above_hull: 0.180516 eV/atom; predicted_stable: False