Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -148.7875 eV; energy change = -631.2394 eV; symmetry: I4/mmm → P1
Crystal structure generated by TreeQuest optimization (file 15)
Phase diagram of Al(FeB)2; eabovehull: 1.458018 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -57.2022 eV; energy change = 1.6006 eV; symmetry: I4/mmm → I4/mmm
Crystal structure generated by TreeQuest optimization (file 14)
Phase diagram of MnFe2CoSiB2; eabovehull: 1.671397 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -43.3803 eV; energy change = -15.9616 eV; symmetry: P4/mmm → P4/mmm
Crystal structure generated by TreeQuest optimization (file 13)
Phase diagram of FeCoNi2B; eabovehull: 1.022118 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -118.9028 eV; energy change = -79.7795 eV; symmetry: P42/mmc → P42/mmc
Crystal structure generated by TreeQuest optimization (file 12)
Phase diagram of Mn2Cr2FeCoSi2; eabovehull: 5.488795 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -45.8090 eV; energy change = -160.0962 eV; symmetry: I4/mmm → Pm
Crystal structure generated by TreeQuest optimization (file 11)
Phase diagram of Mn7Al12Fe4Co5B6; eabovehull: 1.895419 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -126.6805 eV; energy change = -21.5836 eV; symmetry: I4/mmm → I4/mmm
Crystal structure generated by TreeQuest optimization (file 10)
Phase diagram of MnCrFeB; eabovehull: 2.067560 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -53.6046 eV; energy change = 0.0000 eV; symmetry: Cmmm → Cmmm
Crystal structure generated by TreeQuest optimization (file 9)