Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -16.2918 eV; energy change = 0.0000 eV; symmetry: P-6m2 → P-6m2
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -16.2918 eV; energy change = 0.0000 eV; symmetry: P-6m2 → P-6m2
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -16.2918 eV; energy change = 0.0000 eV; symmetry: P-6m2 → P-6m2
Phase diagram of FeN; e_above_hull: 0.366793 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -16.2918 eV; energy change = 0.0000 eV; symmetry: P-6m2 → P-6m2
Phase diagram of FeN; e_above_hull: 0.366793 eV/atom; predicted_stable: False
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -16.2918 eV; energy change = 0.0000 eV; symmetry: P-6m2 → P-6m2
FeCoN (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm)
FeCoN (space group: P-6m2 #187, crystal system: hexagonal, point group: -6m2)
FeN (space group: P-6m2 #187, crystal system: hexagonal, point group: -6m2)
FeN (space group: P-6m2 #187, crystal system: hexagonal, point group: -6m2)
FeN (space group: P-6m2 #187, crystal system: hexagonal, point group: -6m2)
FeN (space group: P-6m2 #187, crystal system: hexagonal, point group: -6m2)
FeN (space group: P-6m2 #187, crystal system: hexagonal, point group: -6m2)
(Space group: P1 #1, Crystal system: triclinic, Point group: 1)
Superconductor candidates sampled at a target Tc of 130k
400 .cif files of candidate structures property condition generated by MatterGen where tc = 298.15K