Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -43.7935 eV; energy change = -51.7981 eV; symmetry: P1 → Cm
Magnet candidate: VFe2CoMo
Phase diagram of Fe2Co; eabovehull: 0.040959 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -36.2619 eV; energy change = -64.3221 eV; symmetry: P1 → P1
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -24.0391 eV; energy change = -23.1355 eV; symmetry: Pmmm → Fmmm
Magnet candidate: ZrFe2CoMo
Phase diagram of Fe2Co; eabovehull: 0.817919 eV/atom; predicted_stable: False
Magnet candidate: Fe2Co
Phase diagram of Fe2CoW; eabovehull: 0.173133 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -21.7080 eV; energy change = -20.8044 eV; symmetry: Pmmm → Pmmm
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -36.4456 eV; energy change = -74.2198 eV; symmetry: Pmmm → Pmm2
Magnet candidate: Fe2Co
Phase diagram of TiFe2CoW; eabovehull: 0.174441 eV/atom; predicted_stable: False
Magnet candidate: Fe2CoW
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -44.9681 eV; energy change = -59.2078 eV; symmetry: P1 → Cm
Magnet candidate: TiFe2CoW
Phase diagram of Fe3CoW; eabovehull: 0.401554 eV/atom; predicted_stable: False
Phase diagram of VFe2CoMo; eabovehull: 0.138589 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -43.6093 eV; energy change = -15.9559 eV; symmetry: Amm2 → Amm2
Magnet candidate: Fe3CoW