25 files0 folders32.6 kB

Columns for the archive contents
Name	Type	Size

Files and folders contained in this archive
	Folder	—
001_Fe13N_16meV.cif	CIF	1.4 kB
002_Fe10N_19meV.cif	CIF	1.2 kB
003_Fe15N_22meV.cif	CIF	1.5 kB
004_Fe9N_30meV.cif	CIF	1.2 kB
005_Fe11N_31meV.cif	CIF	1.3 kB
006_Fe7N_31meV.cif	CIF	1.1 kB
007_Fe12N2_32meV.cif	CIF	1.0 kB
008_CoFe11N_36meV.cif	CIF	1.4 kB
009_CoFe14N_39meV.cif	CIF	1.5 kB
010_CoFe9N_39meV.cif	CIF	1.3 kB
011_CoFe13N2_40meV.cif	CIF	1.5 kB
012_Fe5N_42meV.cif	CIF	973 B
013_Fe14N2_46meV.cif	CIF	1.5 kB
014_CoFe7N2_49meV.cif	CIF	1.2 kB
015_Co2Fe10N_52meV.cif	CIF	1.4 kB
016_Co2Fe11N_52meV.cif	CIF	1.4 kB
017_CoFe9N2_53meV.cif	CIF	1.3 kB
018_Co2Fe6N_54meV.cif	CIF	1.1 kB
019_Co2Fe8N_56meV.cif	CIF	1.3 kB
020_CoFe8N_58meV.cif	CIF	1.2 kB
021_Co4Fe11N_60meV.cif	CIF	1.5 kB
022_Co2Fe7N_61meV.cif	CIF	1.2 kB
023_Co3Fe11N_62meV.cif	CIF	1.5 kB
024_CoFe6N_62meV.cif	CIF	1.1 kB
025_Co4Fe10N_66meV.cif	CIF	1.5 kB

Aug 20

GGen candidate CIFs for Co-Fe-N 2

Name: GGen candidate CIFs for Co-Fe-N 2
Creator: mmoderwell
Published: 2026-08-20T06:25:16.056+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

Data Docs Logs

25 files0 folders32.6 kB

Columns for the archive contents
Name	Type	Size

Files and folders contained in this archive
	Folder	—
001_Fe13N_16meV.cif	CIF	1.4 kB
002_Fe10N_19meV.cif	CIF	1.2 kB
003_Fe15N_22meV.cif	CIF	1.5 kB
004_Fe9N_30meV.cif	CIF	1.2 kB
005_Fe11N_31meV.cif	CIF	1.3 kB
006_Fe7N_31meV.cif	CIF	1.1 kB
007_Fe12N2_32meV.cif	CIF	1.0 kB
008_CoFe11N_36meV.cif	CIF	1.4 kB
009_CoFe14N_39meV.cif	CIF	1.5 kB
010_CoFe9N_39meV.cif	CIF	1.3 kB
011_CoFe13N2_40meV.cif	CIF	1.5 kB
012_Fe5N_42meV.cif	CIF	973 B
013_Fe14N2_46meV.cif	CIF	1.5 kB
014_CoFe7N2_49meV.cif	CIF	1.2 kB
015_Co2Fe10N_52meV.cif	CIF	1.4 kB
016_Co2Fe11N_52meV.cif	CIF	1.4 kB
017_CoFe9N2_53meV.cif	CIF	1.3 kB
018_Co2Fe6N_54meV.cif	CIF	1.1 kB
019_Co2Fe8N_56meV.cif	CIF	1.3 kB
020_CoFe8N_58meV.cif	CIF	1.2 kB
021_Co4Fe11N_60meV.cif	CIF	1.5 kB
022_Co2Fe7N_61meV.cif	CIF	1.2 kB
023_Co3Fe11N_62meV.cif	CIF	1.5 kB
024_CoFe6N_62meV.cif	CIF	1.1 kB
025_Co4Fe10N_66meV.cif	CIF	1.5 kB

Overview

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GGen exploration results for Co-Fe-N 2
GGen ran 1,000 trials across 100 Co-Fe-N stoichiometries in 23.5 min, keeping 832 relaxed structures. 53 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 Fe13N in C2/m (#12), which sits 16 meV/atom above the hull (new composition).

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Selected stable or near-hull GGen candidates as CIF files

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Size: 17.32 KB
Type: .zip file
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Connections

1

Referenced by

GGen exploration results for Co-Fe-N 2
GGen ran 1,000 trials across 100 Co-Fe-N stoichiometries in 23.5 min, keeping 832 relaxed structures. 53 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 Fe13N in C2/m (#12), which sits 16 meV/atom above the hull (new composition).

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