Fe2CoC (P4/mmm) - relaxed
Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -29.6094 eV; energy change = 0.0000 eV; symmetry: P4/mmm → P4/mmm
Fe2CoC (P4/mmm)
.cif fileFe2CoC (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm)
3moFe2CoC (P4/mmm) - relaxed - doped N 5.0%
.cif fileInterstitially doped with N at ~5.0%; supercell [2, 2, 2]; dopant atoms = 2
3mo
1 input asset
1 derivative asset
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