Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -36.5331 eV; energy change = -8.3643 eV; symmetry: P1 → P1
Magnet candidate: CeFe2CoIrC
Phase diagram of FeCoNi2MoPt2; eabovehull: 0.173118 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -50.2043 eV; energy change = -9.3143 eV; symmetry: Pmm2 → P-4m2
Magnet candidate: FeCoNi2MoPt2
Phase diagram of FeSiC; eabovehull: 1.180071 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -20.5631 eV; energy change = -1.4835 eV; symmetry: P4/mmm → P4/mmm
Magnet candidate: FeSiC
Phase diagram of AlFeNi; eabovehull: 0.368111 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -18.1550 eV; energy change = -8.3021 eV; symmetry: R3m → F-43m
Magnet candidate: AlFeNi
Phase diagram of FeSiC; eabovehull: 1.180089 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -20.5633 eV; energy change = -1.4839 eV; symmetry: P4/mmm → P4/mmm
Magnet candidate: FeSiC
Phase diagram of AlFeNi; eabovehull: 0.368073 eV/atom; predicted_stable: False
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -18.1550 eV; energy change = -8.3020 eV; symmetry: R3m → F-43m
Magnet candidate: AlFeNi
Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -12.8771 eV; energy change = 1.9111 eV; symmetry: Pmm2 → P1
Magnet candidate: FeCoW
Phase diagram of FeCo; eabovehull: 0.785482 eV/atom; predicted_stable: False