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Fe12Co2BN (P4/mmm) - relaxed · Files on Ouro

19d

Fe12Co2BN (P4/mmm) - relaxed

Relaxed with Orb v3; 0.03 eV/Å threshold; final energy = -101.7875 eV; energy change = -47.0249 eV; symmetry: P4/mmm → P1

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.cif file

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Relax a crystal structure

1 input asset

Fe12Co2BN (P4/mmm)
.cif file
Fe12Co2BN (space group: P4/mmm #123, crystal system: tetragonal, point group: 4/mmm)
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1 derivative asset

Fe12Co2BN phase diagram
.html file
Phase diagram of Fe12Co2BN; e_above_hull: 1.983509 eV/atom; predicted_stable: False
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