Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -187.4995 eV; energy change = -58.4393 eV; symmetry: P4 → P1

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -155.4034 eV; energy change = -26.8804 eV; symmetry: P4 → P1

Crystal structure generated by GEPA optimization (iteration 4)

Crystal structure generated by GEPA optimization (iteration 3)

Phase diagram of MnFeNiB; eabovehull: 0.269903 eV/atom; predicted_stable: False

Phase diagram of MnFeNiB; eabovehull: 0.270019 eV/atom; predicted_stable: False

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -120.5864 eV; energy change = -14.7587 eV; symmetry: P4 → Pm

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -120.5858 eV; energy change = -14.7587 eV; symmetry: P4 → Pm

Crystal structure generated by GEPA optimization (iteration 2)

Crystal structure generated by GEPA optimization (iteration 1)

Phase diagram of Fe5Co2SiBN; eabovehull: 5.494917 eV/atom; predicted_stable: False

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -52.2472 eV; energy change = 34.6179 eV; symmetry: P1 → P1

Crystal structure generated by GEPA optimization (iteration 21)

Phase diagram of Mn2Fe12SiNi2B; eabovehull: 0.129655 eV/atom; predicted_stable: False

Phase diagram of Fe20Co6SiB2N; eabovehull: 0.241697 eV/atom; predicted_stable: False

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -143.7040 eV; energy change = -23.5480 eV; symmetry: P1 → P1

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -237.3377 eV; energy change = -35.4943 eV; symmetry: P1 → P1

Phase diagram of Fe22Co4SiB2C; eabovehull: 0.172596 eV/atom; predicted_stable: False

Crystal structure generated by GEPA optimization (iteration 20)

Crystal structure generated by GEPA optimization (iteration 19)