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GGen exploration summary for Bi-Fe-Ni · Files on Ouro

Aug 23

GGen exploration summary for Bi-Fe-Ni

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Structured exploration summary, parameters, database stats, and stable phase metadata

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Size: 80.61 KB
Type: .json file
Downloads: 0

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GGen exploration results for Bi-Fe-Ni
GGen ran 770 trials across 77 Bi-Fe-Ni stoichiometries in 16.6 min, keeping 734 relaxed structures. 27 of them landed within 150 meV/atom of the convex hull, 23 of which the database had not seen before. The leading generated candidate is Fe8Ni8 in P4/mmm (#123), which sits 0 meV/atom above the hull (known).