| Formula | Gap (eV) | Free Energy (eV) | Space group type | Space group | Comment | Calculation progress |
|---|---|---|---|---|---|---|
| Fe7W6 | 0 | -93.775 | 'R-3m' | 166 | MatHub3d-47910-Fe7W6 | Band |
| Fe4Y2 | 0 | -32.707 | 'Fd-3m' | 227 | MatHub3d-47603-Fe4Y2 | Band |
| Fe5Y1 | 0 | -30.720 | 'P6/mmm' | 191 | MatHub3d-47688-Fe5Y1 | Band |
| Na16O28P8 | 4.418 | -319.423 | 'P2_12_12_1' | 19 | MatHub3d-66558-Na16O28P8 | Transport |
| Fe23Y6 | 0 | -151.831 | 'Fm-3m' | 225 | MatHub3d-48517-Fe23Y6 | Band |
| Fe4Yb2 | 0 | -23.005 | 'Fd-3m' | 227 | MatHub3d-47604-Fe4Yb2 | Band |
| Fe23Yb6 | 0 | -121.883 | 'Fm-3m' | 225 | MatHub3d-48518-Fe23Yb6 | Band |
| Fe8Zr16 | 0 | -175.213 | 'Fd-3m' | 227 | MatHub3d-48176-Fe8Zr16 | Band |
| Fe4Zr2 | 0 | -36.934 | 'Fd-3m' | 227 | MatHub3d-47605-Fe4Zr2 | Band |
| Fe23Zr6 | 0 | -164.965 | 'Fm-3m' | 225 | MatHub3d-48519-Fe23Zr6 | Band |
| Ga2Gd1 | 0 | -12.295 | 'P6/mmm' | 191 | MatHub3d-48747-Ga2Gd1 | Band |
| Ga6Gd2Mn1 | 0 | -37.332 | 'Fm-3m' | 225 | MatHub3d-49145-Ga6Gd2Mn1 | Band |
| Ga12Hf12 | 0 | -165.692 | 'Pbcm' | 57 | MatHub3d-49331-Ga12Hf12 | Band |
| Ga8Hf4 | 0 | -68.173 | 'I4_1/amd' | 141 | MatHub3d-49224-Ga8Hf4 | Band |
| Ga3Hf1 | 0 | -20.146 | 'I4/mmm' | 139 | MatHub3d-48904-Ga3Hf1 | Band |
| Ga6Hf4 | 0 | -62.044 | 'Fdd2' | 43 | MatHub3d-49151-Ga6Hf4 | Band |
| Ga6Hf10 | 0 | -123.414 | 'P6_3/mcm' | 193 | MatHub3d-49155-Ga6Hf10 | Band |
| Ga12Hf6Mn4 | 0 | -128.947 | 'Pmmn' | 59 | MatHub3d-49330-Ga12Hf6Mn4 | Band |
| Ga6Hf6Nb4 | 0 | -117.476 | 'P6_3/mcm' | 193 | MatHub3d-49152-Ga6Hf6Nb4 | Band |
| Ga1Hf1Ni2 | 0 | -19.852 | 'Fm-3m' | 225 | MatHub3d-48589-Ga1Hf1Ni2 | Band |
| Ga18Ho6 | 0 | -91.006 | 'P6_3/mmc' | 194 | MatHub3d-49415-Ga18Ho6 | Band |
| Ga4Ho4Ni4 | 0 | -46.606 | 'Pnma' | 62 | MatHub3d-48988-Ga4Ho4Ni4 | Band |
| Ga8Ho2Ni2 | 0 | -43.422 | 'Cmcm' | 63 | MatHub3d-49227-Ga8Ho2Ni2 | Band |
| Ga1Ir1 | 0 | -10.135 | 'Pm-3m' | 221 | MatHub3d-48596-Ga1Ir1 | Band |
| Ga1La3 | 0 | -17.895 | 'Pm-3m' | 221 | MatHub3d-48608-Ga1La3 | Band |