Fe12Mn2Bi2 (auto-selected space group: P6_3/mcm #193)

Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -44.6110 eV; energy change = -0.0702 eV; symmetry: P-6m2 → P-6m2

Cell + Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -49.8343 eV; energy change = -5.2936 eV; symmetry: P-6m2 → P-6m2

Fe6BiNiS (auto-selected space group: P-6m2 #187)

Ionic relaxation with Orb v3; 0.03 eV/Å threshold; final energy = -184.6118 eV; energy change = -0.0207 eV; symmetry: Amm2 → Amm2

Fe10Co5B2C (requested SG: P4mm #99, calculated SG: P1 #1, optimized: 223 steps, cell relaxed (isotropic))

Fe15Co5Ni2Al1Cu1B3N2 (requested SG: P6mm #183, calculated SG: P1 #1, optimized: 357 steps, cell relaxed (isotropic))

Phase diagram of AlFe7Co2BN; eabovehull: 0.347476 eV/atom; predicted_stable: False

Fe14Co4Al2B2N2 (requested SG: P4/mmm #123, calculated SG: P1 #1, optimized: 245 steps, cell relaxed (isotropic))

Phase diagram of Ti2Fe16Co4Ni16BP2; eabovehull: 0.169974 eV/atom; predicted_stable: False

Fe16Ni16Co4Ti2P2B (requested SG: P4/mmm #123, calculated SG: P1 #1, optimized: 340 steps, cell relaxed (isotropic))

Phase diagram of Ti2Fe16Ni16B; eabovehull: 0.168727 eV/atom; predicted_stable: False

Fe16Ni16Ti2B (requested SG: P4/mmm #123, calculated SG: P1 #1, optimized: 254 steps, cell relaxed (isotropic))

Phase diagram of Al2Fe8Co4Ni2B2N; eabovehull: 0.274988 eV/atom; predicted_stable: False

Fe8Co4Al2Ni2B2N (requested SG: P4/mmm #123, calculated SG: P1 #1, optimized: 400 steps, cell relaxed (isotropic))

Phase diagram of Fe10Co4B2C; eabovehull: 0.280952 eV/atom; predicted_stable: False

Fe10Co4B2C (requested SG: P-62m #189, calculated SG: P1 #1, optimized: 400 steps, cell relaxed (isotropic))

Phase diagram of GaFe16Ni16B; eabovehull: 0.143120 eV/atom; predicted_stable: False

Fe16Ni16Ga1B1 (requested SG: P4/mmm #123, calculated SG: P1 #1, optimized: 193 steps, cell relaxed (isotropic))

Phase diagram of Fe8Co3SiB2; eabovehull: 0.168249 eV/atom; predicted_stable: False