Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -33.1602 eV; energy change = -5.8637 eV; symmetry: Cm → P-6m2
Crystal structure for Mn3Si generated by GPSK-300 (3-channel reciprocal-space DiT). 4 sites, min distance 1.935A, selected from 2 candidates.
Phase diagram of Mn3Si with Orb v3 conservative inf MPA; eabovehull: 0.227448 eV/atom; predicted_stable: False
Long-form calculated properties extracted from successful route actions that used each CIF as an input. Columns fileid / actionid / route_id are Ouro references.
Comprehensive compilation of every RE-free magnetic compound found on Ouro, built using ouro-py files.search() across all 13,501 CIF files on the platform. 4,319 unique formulas from 12,291 matching CIF files. Parsed with pymatgen for formula, space group, and composition. Filtered: at least one ferromagnetic element (Fe,Co,Ni,Mn,Cr), no rare earths (Sc,Y,lanthanides).