Aug 19

GGen candidate CIFs for Co-Fe-N-Ti

Name: GGen candidate CIFs for Co-Fe-N-Ti
Creator: mmoderwell
Published: 2026-08-19T05:58:33.422+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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Selected stable or near-hull GGen candidates as CIF files

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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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