Aug 1

B2Fe4 — I4/mcm (#140)

Name: B2Fe4 — I4/mcm (#140)
Creator: mmoderwell
Published: 2026-08-01T20:27:16.144+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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GGen exploration results for B-Fe
GGen ran 1,360 trials across 68 B-Fe stoichiometries in 22.2 min, keeping 1,297 relaxed structures. 39 of them landed within 150 meV/atom of the convex hull, 37 of which the database had not seen before. The leading generated candidate is B2Fe4 in I4/mcm (#140), which sits on the hull (known).

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GGen B-Fe candidate: I4/mcm (#140), on the hull, -8.178 eV/atom, 12 atoms

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Size: 974 B
Type: .cif file
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Connections

1

Referenced by

GGen exploration results for B-Fe
GGen ran 1,360 trials across 68 B-Fe stoichiometries in 22.2 min, keeping 1,297 relaxed structures. 39 of them landed within 150 meV/atom of the convex hull, 37 of which the database had not seen before. The leading generated candidate is B2Fe4 in I4/mcm (#140), which sits on the hull (known).

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