Aug 22

GGen candidate CIFs for B-Co-Fe-Sb 1

Name: GGen candidate CIFs for B-Co-Fe-Sb 1
Creator: mmoderwell
Published: 2026-08-22T07:11:36.355+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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GGen exploration results for B-Co-Fe-Sb 1
GGen ran 1,000 trials across 100 B-Co-Fe-Sb stoichiometries in 22.6 min, keeping 941 relaxed structures. 30 of them landed within 150 meV/atom of the convex hull, 30 of which the database had not seen before. The leading generated candidate is Co5Fe3 in P4/mmm (#123), which sits 18 meV/atom above the hull (new polymorph).

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Selected stable or near-hull GGen candidates as CIF files

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Type: .zip file
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Referenced by

GGen exploration results for B-Co-Fe-Sb 1
GGen ran 1,000 trials across 100 B-Co-Fe-Sb stoichiometries in 22.6 min, keeping 941 relaxed structures. 30 of them landed within 150 meV/atom of the convex hull, 30 of which the database had not seen before. The leading generated candidate is Co5Fe3 in P4/mmm (#123), which sits 18 meV/atom above the hull (new polymorph).

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