25 files0 folders34.5 kB

Columns for the archive contents
Name	Type	Size

Files and folders contained in this archive
	Folder	—
001_Fe15N_21meV.cif	CIF	1.5 kB
002_Fe13N_26meV.cif	CIF	1.4 kB
003_Fe9N_30meV.cif	CIF	1.2 kB
004_Fe11N_38meV.cif	CIF	1.3 kB
005_CoFe10N_44meV.cif	CIF	1.3 kB
006_Co2Fe11N_48meV.cif	CIF	1.4 kB
007_Co3Fe12N_51meV.cif	CIF	1.5 kB
008_Fe14N2_56meV.cif	CIF	1.5 kB
009_Co6Fe5N_63meV.cif	CIF	1.3 kB
010_Co3Fe10N_67meV.cif	CIF	1.4 kB
011_CoFe5N_67meV.cif	CIF	1.0 kB
012_Co7Fe6N_67meV.cif	CIF	1.4 kB
013_Co6Fe6N_67meV.cif	CIF	1.4 kB
014_Co5Fe4N_68meV.cif	CIF	1.2 kB
015_Co2Fe6N_68meV.cif	CIF	1.1 kB
016_Co4Fe8N_69meV.cif	CIF	1.4 kB
017_Co7Fe6N2_70meV.cif	CIF	1.5 kB
018_Co5Fe10N_75meV.cif	CIF	1.5 kB
019_Co4Fe4N_77meV.cif	CIF	1.1 kB
020_CoFe13N2_78meV.cif	CIF	1.5 kB
021_Fe13NV_80meV.cif	CIF	1.5 kB
022_CoFe11NV_82meV.cif	CIF	1.4 kB
023_Co3Fe11N2_82meV.cif	CIF	1.5 kB
024_Co2Fe11N2_85meV.cif	CIF	1.5 kB
025_Co6Fe6N2_88meV.cif	CIF	1.4 kB

Aug 19

GGen candidate CIFs for Co-Fe-N-V

Name: GGen candidate CIFs for Co-Fe-N-V
Creator: mmoderwell
Published: 2026-08-19T06:25:42.065+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

Data Docs Logs

25 files0 folders34.5 kB

Columns for the archive contents
Name	Type	Size

Files and folders contained in this archive
	Folder	—
001_Fe15N_21meV.cif	CIF	1.5 kB
002_Fe13N_26meV.cif	CIF	1.4 kB
003_Fe9N_30meV.cif	CIF	1.2 kB
004_Fe11N_38meV.cif	CIF	1.3 kB
005_CoFe10N_44meV.cif	CIF	1.3 kB
006_Co2Fe11N_48meV.cif	CIF	1.4 kB
007_Co3Fe12N_51meV.cif	CIF	1.5 kB
008_Fe14N2_56meV.cif	CIF	1.5 kB
009_Co6Fe5N_63meV.cif	CIF	1.3 kB
010_Co3Fe10N_67meV.cif	CIF	1.4 kB
011_CoFe5N_67meV.cif	CIF	1.0 kB
012_Co7Fe6N_67meV.cif	CIF	1.4 kB
013_Co6Fe6N_67meV.cif	CIF	1.4 kB
014_Co5Fe4N_68meV.cif	CIF	1.2 kB
015_Co2Fe6N_68meV.cif	CIF	1.1 kB
016_Co4Fe8N_69meV.cif	CIF	1.4 kB
017_Co7Fe6N2_70meV.cif	CIF	1.5 kB
018_Co5Fe10N_75meV.cif	CIF	1.5 kB
019_Co4Fe4N_77meV.cif	CIF	1.1 kB
020_CoFe13N2_78meV.cif	CIF	1.5 kB
021_Fe13NV_80meV.cif	CIF	1.5 kB
022_CoFe11NV_82meV.cif	CIF	1.4 kB
023_Co3Fe11N2_82meV.cif	CIF	1.5 kB
024_Co2Fe11N2_85meV.cif	CIF	1.5 kB
025_Co6Fe6N2_88meV.cif	CIF	1.4 kB

Overview

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GGen exploration results for Co-Fe-N-V
GGen ran 1,000 trials across 100 Co-Fe-N-V stoichiometries in 25.5 min, keeping 881 relaxed structures. 45 of them landed within 150 meV/atom of the convex hull, 45 of which the database had not seen before. The leading generated candidate is Fe15N in C2/m (#12), which sits 22 meV/atom above the hull (new composition).

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ARR license

Selected stable or near-hull GGen candidates as CIF files

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Size: 17.76 KB
Type: .zip file
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Connections

1

Referenced by

GGen exploration results for Co-Fe-N-V
GGen ran 1,000 trials across 100 Co-Fe-N-V stoichiometries in 25.5 min, keeping 881 relaxed structures. 45 of them landed within 150 meV/atom of the convex hull, 45 of which the database had not seen before. The leading generated candidate is Fe15N in C2/m (#12), which sits 22 meV/atom above the hull (new composition).

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