| Formula | Gap (eV) | Free Energy (eV) | Space group type | Space group | Comment | Calculation progress |
|---|---|---|---|---|---|---|
| Co2Zr6 | 0 | -57.835 | 'Cmcm' | 63 | MatHub3d-32330-Co2Zr6 | Band |
| Co4Zr2 | 0 | -31.217 | 'Fd-3m' | 227 | MatHub3d-33202-Co4Zr2 | Band |
| Cr1Fe2Ga1 | 0 | -17.927 | 'Fm-3m' | 225 | MatHub3d-34073-Cr1Fe2Ga1 | Band |
| Cr6Ga2 | 0 | -38.289 | 'Pm-3n' | 223 | MatHub3d-35695-Cr6Ga2 | Band |
| Cr4Hf2 | 0 | -41.743 | 'Fd-3m' | 227 | MatHub3d-35304-Cr4Hf2 | Band |
| Cr6Ir2 | 0 | -46.313 | 'Pm-3n' | 223 | MatHub3d-35709-Cr6Ir2 | Band |
| Pd2Tl4 | 0 | -16.469 | 'I4/mcm' | 140 | MatHub3d-71784-Pd2Tl4 | Band |
| Pt2Tl4 | 0 | -17.350 | 'I4/mcm' | 140 | MatHub3d-72159-Pt2Tl4 | Band |
| Au2Tl4 | 0 | -11.593 | 'I4/mcm' | 140 | MatHub3d-7907-Au2Tl4 | Band |
| Br2Ca2Cu1O2 | 0 | -32.866 | 'I4/mmm' | 139 | MatHub3d-17280-Br2Ca2Cu1O2 | Band |
| Pb4Pd2 | 0 | -22.195 | 'I4/mcm' | 140 | MatHub3d-71617-Pb4Pd2 | Band |
| Fe2Zr4 | 0 | -43.754 | 'I4/mcm' | 140 | MatHub3d-46748-Fe2Zr4 | Band |
| Ni2Zr4 | 0 | -40.530 | 'I4/mcm' | 140 | MatHub3d-67657-Ni2Zr4 | Band |
| Ga2Zr4 | 0 | -42.595 | 'I4/mcm' | 140 | MatHub3d-48897-Ga2Zr4 | Band |
| Rh2Zr4 | 0 | -45.615 | 'I4/mcm' | 140 | MatHub3d-72614-Rh2Zr4 | Band |
| Hf4Ni2 | 0 | -46.225 | 'I4/mcm' | 140 | MatHub3d-53786-Hf4Ni2 | Band |
| Ga2Hf4 | 0 | -47.836 | 'I4/mcm' | 140 | MatHub3d-48762-Ga2Hf4 | Band |
| Th4Zn2 | 0 | -31.176 | 'I4/mcm' | 140 | MatHub3d-73930-Th4Zn2 | Band |
| Ga2Th4 | 0 | -37.680 | 'I4/mcm' | 140 | MatHub3d-48887-Ga2Th4 | Band |
| In2Th4 | 0 | -35.832 | 'I4/mcm' | 140 | MatHub3d-55772-In2Th4 | Band |
| Co2Ta4 | 0 | -46.718 | 'I4/mcm' | 140 | MatHub3d-32317-Co2Ta4 | Band |
| Ni2Ta4 | 0 | -46.043 | 'I4/mcm' | 140 | MatHub3d-67643-Ni2Ta4 | Band |
| Cr6Os2 | 0 | -48.705 | 'Pm-3n' | 223 | MatHub3d-35795-Cr6Os2 | Band |
| Cl1O3Rb1 | 5.341 | -21.280 | 'R3m' | 160 | MatHub3d-28692-Cl1O3Rb1 | Band |
| Cr1Pt3 | 0 | -19.953 | 'Pm-3m' | 221 | MatHub3d-34333-Cr1Pt3 | Band |