25 files0 folders33.1 kB

Columns for the archive contents
Name	Type	Size

Files and folders contained in this archive
	Folder	—
001_Fe14N2_27meV.cif	CIF	1.5 kB
002_Fe11N_31meV.cif	CIF	1.3 kB
003_Fe7N_31meV.cif	CIF	1.1 kB
004_Fe11N2_38meV.cif	CIF	1.4 kB
005_Fe9N2_47meV.cif	CIF	1.2 kB
006_Co2Fe10N_54meV.cif	CIF	1.4 kB
007_Fe13MoN_54meV.cif	CIF	1.5 kB
008_CoFe9N_55meV.cif	CIF	1.3 kB
009_CoFe11N2_58meV.cif	CIF	1.4 kB
010_CoFe13N2_59meV.cif	CIF	1.5 kB
011_CoFe3N_61meV.cif	CIF	929 B
012_Co2Fe12N2_62meV.cif	CIF	1.5 kB
013_Co2Fe10N3_64meV.cif	CIF	1.5 kB
014_Co2Fe6MoN_65meV.cif	CIF	1.2 kB
015_Co2Fe8N_67meV.cif	CIF	1.3 kB
016_Fe7MoN_68meV.cif	CIF	1.1 kB
017_Fe7MoN2_68meV.cif	CIF	1.2 kB
018_Co2Fe10N2_70meV.cif	CIF	1.0 kB
019_Fe9MoN_74meV.cif	CIF	1.3 kB
020_CoFe13MoN_74meV.cif	CIF	1.5 kB
021_CoFe10MoN_78meV.cif	CIF	1.4 kB
022_Fe13MoN2_81meV.cif	CIF	1.5 kB
023_Fe11MoN2_83meV.cif	CIF	1.4 kB
024_CoFe11MoN_84meV.cif	CIF	1.4 kB
025_Fe8MoN_87meV.cif	CIF	1.2 kB

Aug 19

GGen candidate CIFs for Co-Fe-Mo-N

Name: GGen candidate CIFs for Co-Fe-Mo-N
Creator: mmoderwell
Published: 2026-08-19T07:12:46.358+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_Fe14N2_27meV.cif	CIF	1.5 kB
002_Fe11N_31meV.cif	CIF	1.3 kB
003_Fe7N_31meV.cif	CIF	1.1 kB
004_Fe11N2_38meV.cif	CIF	1.4 kB
005_Fe9N2_47meV.cif	CIF	1.2 kB
006_Co2Fe10N_54meV.cif	CIF	1.4 kB
007_Fe13MoN_54meV.cif	CIF	1.5 kB
008_CoFe9N_55meV.cif	CIF	1.3 kB
009_CoFe11N2_58meV.cif	CIF	1.4 kB
010_CoFe13N2_59meV.cif	CIF	1.5 kB
011_CoFe3N_61meV.cif	CIF	929 B
012_Co2Fe12N2_62meV.cif	CIF	1.5 kB
013_Co2Fe10N3_64meV.cif	CIF	1.5 kB
014_Co2Fe6MoN_65meV.cif	CIF	1.2 kB
015_Co2Fe8N_67meV.cif	CIF	1.3 kB
016_Fe7MoN_68meV.cif	CIF	1.1 kB
017_Fe7MoN2_68meV.cif	CIF	1.2 kB
018_Co2Fe10N2_70meV.cif	CIF	1.0 kB
019_Fe9MoN_74meV.cif	CIF	1.3 kB
020_CoFe13MoN_74meV.cif	CIF	1.5 kB
021_CoFe10MoN_78meV.cif	CIF	1.4 kB
022_Fe13MoN2_81meV.cif	CIF	1.5 kB
023_Fe11MoN2_83meV.cif	CIF	1.4 kB
024_CoFe11MoN_84meV.cif	CIF	1.4 kB
025_Fe8MoN_87meV.cif	CIF	1.2 kB

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GGen exploration results for Co-Fe-Mo-N
GGen ran 1,000 trials across 100 Co-Fe-Mo-N stoichiometries in 23.2 min, keeping 829 relaxed structures. 57 of them landed within 150 meV/atom of the convex hull, 57 of which the database had not seen before. The leading generated candidate is Fe14N2 in Cmcm (#63), which sits 28 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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Type: .zip file
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Referenced by

GGen exploration results for Co-Fe-Mo-N
GGen ran 1,000 trials across 100 Co-Fe-Mo-N stoichiometries in 23.2 min, keeping 829 relaxed structures. 57 of them landed within 150 meV/atom of the convex hull, 57 of which the database had not seen before. The leading generated candidate is Fe14N2 in Cmcm (#63), which sits 28 meV/atom above the hull (new composition).

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