Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -124.4766 eV; energy change = -532.7709 eV; symmetry: Pnma → P2_1/c
FeCoMnB generated by o3
Phase diagram of NbFe2(CoB2)2; eabovehull: 0.653535 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -132.4757 eV; energy change = -93.7721 eV; symmetry: I4/mmm → P1
FeCoNbB generated by o3
Phase diagram of CrFeCoB2; eabovehull: 0.802859 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -145.8653 eV; energy change = -622.8852 eV; symmetry: I4/mmm → P1
FeCoCrB generated by o3
Phase diagram of Fe4Co4B2W; eabovehull: 1.164448 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -156.4293 eV; energy change = -6.5320 eV; symmetry: I4/mmm → I4/mmm
FeCoWB generated by Gemini 2.5 Pro
Phase diagram of TiFe2(CoB2)2; eabovehull: 13.228007 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = 96.7966 eV; energy change = -144.8347 eV; symmetry: I4/mmm → Pc
FeCoTiB generated by Gemini 2.5 Pro
Phase diagram of TiFe8Co4N; eabovehull: 3.952087 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -243.8087 eV; energy change = -1801.0343 eV; symmetry: P4/nmm → P1
FeCoTiN generated by Gemini 2.5 Pro
Phase diagram of MnCo2Ge; eabovehull: 1.597827 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -90.1819 eV; energy change = -65.7395 eV; symmetry: Cmcm → Cmcm
CoMnGe generated by Gemini 2.5 Pro