Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -33.5183 eV; energy change = -0.0024 eV; symmetry: P4/mmm → P4/mmm
Fe2CoMnGaC (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm) (missed expected composition: Fe2CoMnGaC)
Phase diagram of Fe2SiNiN; eabovehull: 4.740534 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -35.7540 eV; energy change = -0.0050 eV; symmetry: P4/mmm → P4/mmm
Fe2CoNiSiN (space group: P4mm #99, crystal system: tetragonal, point group: 4mm) (missed expected composition: Fe2CoNiSiN)
Phase diagram of AlFeCoB; eabovehull: 0.490096 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -25.9776 eV; energy change = -22.2966 eV; symmetry: P4mm → P4mm
1 crystal structures generated from text: A crystal structure of FeMnO4 with orthorhombic symmetry-cif
1 crystal structures generated from text: A crystal structure of FeMnO4 with orthorhombic symmetry
FeCoNiAlB2 (space group: P4mm #99, crystal system: tetragonal, point group: 4mm) (missed expected composition: FeCoNiAlB2)
Phase diagram of MnAlSiNi2; eabovehull: 0.431999 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -30.4433 eV; energy change = -0.9490 eV; symmetry: P4mm → P4mm
Ni2MnAlSi (space group: P4mm #99, crystal system: tetragonal, point group: 4mm) (missed expected composition: Ni2MnAlSi)
Phase diagram of MnAlFe4CoB; eabovehull: 0.339390 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -59.9941 eV; energy change = -0.0531 eV; symmetry: P4/mmm → P4/mmm
Fe2CoMnAlB (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm) (missed expected composition: Fe2CoMnAlB)
Phase diagram of AlFeCoB; eabovehull: 4.120878 eV/atom; predicted_stable: False
1 crystal structures generated from text: A crystal structure of FeMnO4 with orthorhombic symmetry-cif
1 crystal structures generated from text: A crystal structure of FeMnO4 with orthorhombic symmetry
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -11.4557 eV; energy change = -0.0011 eV; symmetry: P-6m2 → P-6m2