Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -32.3420 eV; energy change = -10.3637 eV; symmetry: Pmm2 → P2/m

Magnet candidate: TiFe2Co

Phase diagram of Fe2CoMo; eabovehull: 0.147387 eV/atom; predicted_stable: False

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -44.8692 eV; energy change = -59.1089 eV; symmetry: P1 → Cm

Magnet candidate: TiFe2CoW

Phase diagram of Fe2Co; eabovehull: 0.817839 eV/atom; predicted_stable: False

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -34.4160 eV; energy change = -12.6908 eV; symmetry: Pmm2 → P2/m

Magnet candidate: Fe2CoMo

Phase diagram of FeCo; eabovehull: 0.836390 eV/atom; predicted_stable: False

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -21.7084 eV; energy change = -20.8048 eV; symmetry: Pmmm → Pmmm

Magnet candidate: Fe2Co

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -13.9940 eV; energy change = -3.8102 eV; symmetry: P4/mmm → P4/mmm

Magnet candidate: FeCo

Phase diagram of Fe2CoW; eabovehull: 0.166539 eV/atom; predicted_stable: False

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -36.4723 eV; energy change = -12.9777 eV; symmetry: Pmm2 → P2/m

Magnet candidate: Fe2CoW

Phase diagram of Fe2Co; eabovehull: 0.040973 eV/atom; predicted_stable: False

Phase diagram of VFe3Co; eabovehull: 0.013224 eV/atom; predicted_stable: True

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -24.0389 eV; energy change = -10.9614 eV; symmetry: Pmm2 → Fmmm

Magnet candidate: Fe2Co