Selected stable or near-hull GGen candidates as CIF files
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).
/cifkit/ensemble