Aug 19

CoFe3 — P4/mmm (#123)

Name: CoFe3 — P4/mmm (#123)
Creator: mmoderwell
Published: 2026-08-19T05:58:33.362+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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GGen exploration results for Co-Fe-N-Ti
GGen ran 1,000 trials across 100 Co-Fe-N-Ti stoichiometries in 23.0 min, keeping 907 relaxed structures. 35 of them landed within 150 meV/atom of the convex hull, 34 of which the database had not seen before. The leading generated candidate is CoFe3 in P4/mmm (#123), which sits on the hull (known).

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GGen Co-Fe-N-Ti candidate: P4/mmm (#123), on the hull, -8.160 eV/atom, 4 atoms

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Size: 862 B
Type: .cif file
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Referenced by

GGen exploration results for Co-Fe-N-Ti
GGen ran 1,000 trials across 100 Co-Fe-N-Ti stoichiometries in 23.0 min, keeping 907 relaxed structures. 35 of them landed within 150 meV/atom of the convex hull, 34 of which the database had not seen before. The leading generated candidate is CoFe3 in P4/mmm (#123), which sits on the hull (known).

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