Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -28.3771 eV; energy change = -0.0092 eV; symmetry: Pmm2 → Pmm2
Fe2CoAl (space group: Pmm2 #25, crystal system: orthorhombic, point group: mm2)
Supercell 3x3x3 of AlFe2Co (Space group: Pmm2, 108 symmetry operations)
Phonon band structure (supercell [2, 2, 2], Δ=0.01 Å)
Phase diagram of AlFe2Co; e_above_hull: 0.134595 eV/atom; predicted_stable: False
After ran the pipeline, we are left with a handful of our best candidates to continue validating. The next filter they need to pass is a decent magnetocrystalline anisotropy energy. Check out Will's