Aug 23

Fe3NNi — Pm-3m (#221)

Name: Fe3NNi — Pm-3m (#221)
Creator: mmoderwell
Published: 2026-08-23T06:30:15.924+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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GGen exploration results for Al-Fe-N-Ni
GGen ran 1,000 trials across 100 Al-Fe-N-Ni stoichiometries in 28.6 min, keeping 916 relaxed structures. 54 of them landed within 150 meV/atom of the convex hull, 53 of which the database had not seen before. The leading generated candidate is Fe3NNi in Pm-3m (#221), which sits 36 meV/atom above the hull (known).

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GGen Al-Fe-N-Ni candidate: Pm-3m (#221), 36 meV/atom above the hull, -7.944 eV/atom, 5 atoms

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Size: 917 B
Type: .cif file
Downloads: 0

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Connections

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Referenced by

GGen exploration results for Al-Fe-N-Ni
GGen ran 1,000 trials across 100 Al-Fe-N-Ni stoichiometries in 28.6 min, keeping 916 relaxed structures. 54 of them landed within 150 meV/atom of the convex hull, 53 of which the database had not seen before. The leading generated candidate is Fe3NNi in Pm-3m (#221), which sits 36 meV/atom above the hull (known).

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