25 files0 folders33.1 kB

Columns for the archive contents
Name	Type	Size

Files and folders contained in this archive
	Folder	—
001_Fe8N2_8meV.cif	CIF	1.2 kB
002_CoFe12N_46meV.cif	CIF	1.4 kB
003_CoFe12N2_54meV.cif	CIF	1.5 kB
004_CoFe11N2_59meV.cif	CIF	1.4 kB
005_CoFe3N_61meV.cif	CIF	929 B
006_Co2Fe6N2_61meV.cif	CIF	929 B
007_CoFe8N_62meV.cif	CIF	1.2 kB
008_Co7Fe8N_64meV.cif	CIF	1.5 kB
009_Co3Fe12N_64meV.cif	CIF	1.5 kB
010_Co3Fe5N_68meV.cif	CIF	1.1 kB
011_Co4Fe8N_70meV.cif	CIF	1.4 kB
012_Co2Fe8N_71meV.cif	CIF	1.3 kB
013_CoFe11N3_72meV.cif	CIF	1.5 kB
014_Co5Fe7N2_72meV.cif	CIF	1.4 kB
015_Co5Fe7N_76meV.cif	CIF	1.4 kB
016_Co7Fe6N2_78meV.cif	CIF	1.5 kB
017_CoFe9N2_81meV.cif	CIF	1.3 kB
018_Co6Fe5N_83meV.cif	CIF	1.3 kB
019_Co7Fe7N_83meV.cif	CIF	1.5 kB
020_Co4Fe10N2_86meV.cif	CIF	1.5 kB
021_Co2Fe3N_89meV.cif	CIF	983 B
022_Co2Fe12N2_89meV.cif	CIF	1.5 kB
023_Co4Fe5N_90meV.cif	CIF	1.2 kB
024_Co2Fe7N_92meV.cif	CIF	1.2 kB
025_Co7Fe6N_101meV.cif	CIF	1.4 kB

Aug 18

GGen candidate CIFs for Al-Co-Fe-N

Name: GGen candidate CIFs for Al-Co-Fe-N
Creator: mmoderwell
Published: 2026-08-19T04:36:15.945+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

Data Docs Logs

25 files0 folders33.1 kB

Columns for the archive contents
Name	Type	Size

Files and folders contained in this archive
	Folder	—
001_Fe8N2_8meV.cif	CIF	1.2 kB
002_CoFe12N_46meV.cif	CIF	1.4 kB
003_CoFe12N2_54meV.cif	CIF	1.5 kB
004_CoFe11N2_59meV.cif	CIF	1.4 kB
005_CoFe3N_61meV.cif	CIF	929 B
006_Co2Fe6N2_61meV.cif	CIF	929 B
007_CoFe8N_62meV.cif	CIF	1.2 kB
008_Co7Fe8N_64meV.cif	CIF	1.5 kB
009_Co3Fe12N_64meV.cif	CIF	1.5 kB
010_Co3Fe5N_68meV.cif	CIF	1.1 kB
011_Co4Fe8N_70meV.cif	CIF	1.4 kB
012_Co2Fe8N_71meV.cif	CIF	1.3 kB
013_CoFe11N3_72meV.cif	CIF	1.5 kB
014_Co5Fe7N2_72meV.cif	CIF	1.4 kB
015_Co5Fe7N_76meV.cif	CIF	1.4 kB
016_Co7Fe6N2_78meV.cif	CIF	1.5 kB
017_CoFe9N2_81meV.cif	CIF	1.3 kB
018_Co6Fe5N_83meV.cif	CIF	1.3 kB
019_Co7Fe7N_83meV.cif	CIF	1.5 kB
020_Co4Fe10N2_86meV.cif	CIF	1.5 kB
021_Co2Fe3N_89meV.cif	CIF	983 B
022_Co2Fe12N2_89meV.cif	CIF	1.5 kB
023_Co4Fe5N_90meV.cif	CIF	1.2 kB
024_Co2Fe7N_92meV.cif	CIF	1.2 kB
025_Co7Fe6N_101meV.cif	CIF	1.4 kB

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GGen exploration results for Al-Co-Fe-N
GGen ran 1,000 trials across 100 Al-Co-Fe-N stoichiometries in 23.0 min, keeping 814 relaxed structures. 33 of them landed within 150 meV/atom of the convex hull, 33 of which the database had not seen before. The leading generated candidate is Fe8N2 in Pmna (#53), which sits 8 meV/atom above the hull (new polymorph).

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ARR license

Selected stable or near-hull GGen candidates as CIF files

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Size: 17.45 KB
Type: .zip file
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Connections

1

Referenced by

GGen exploration results for Al-Co-Fe-N
GGen ran 1,000 trials across 100 Al-Co-Fe-N stoichiometries in 23.0 min, keeping 814 relaxed structures. 33 of them landed within 150 meV/atom of the convex hull, 33 of which the database had not seen before. The leading generated candidate is Fe8N2 in Pmna (#53), which sits 8 meV/atom above the hull (new polymorph).

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