| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AgN3 | COD | 1010308 | I4/mcm (140) | ✔ | 8 | 52 | 3 | 1.6092 | 1.609 | 0.000 | (0;000) | ✗ | 05/01/17 |
| NiAgO2 | ICSD | 415451 | P6_3/mmc (194) | ✔ | 8 | 66 | 3 | 0.0 | 0.001 | 0.884 | (0;000) | ✗ | 05/01/17 |
| SnBi | ICSD | 160382 | Cmce (64) | ✔ | 8 | 116 | 3 | 0.0 | 0.071 | 0.547 | (1;110) | ✗ | 06/10/16 |
| ScAgO2 | COD | 1509495 | P6_3/mmc (194) | ✔ | 8 | 68 | 3 | 2.2006 | 2.615 | 0.000 | (0;000) | ✗ | 05/01/17 |
| YAgO2 | COD | 1509496 | P6_3/mmc (194) | ✔ | 8 | 68 | 3 | 2.4715 | 2.676 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AgO | COD | 1509688 | P2_1/c (14) | ✔ | 8 | 68 | 3 | 0.1484 | 0.645 | 0.000 | (0;000) | ✗ | 05/01/17 |
| YAgSb2 | ICSD | 190094 | P4/nmm (129) | ✔ | 8 | 64 | 3 | 0.0 | 0.039 | 0.354 | (1;000) | ✗ | 05/01/17 |
| HfNi2Sb | ICSD | 638718 | P6_3/mmc (194) | ✔ | 8 | 74 | 3 | 0.0 | 0.000 | 0.873 | (0;000) | ✗ | 27/01/17 |
| RbSbO2 | ICSD | 411216 | C2/c (15) | ✔ | 8 | 52 | 1 | 2.2136 | 2.222 | 0.000 | (0;000) | ✗ | 27/01/17 |
| YAl2Co | ICSD | 57645 | Cmcm (63) | ✔ | 8 | 68 | 3 | 0.0 | 0.006 | 0.719 | (0;000) | ✗ | 05/01/17 |
| Al2CuIr | ICSD | 167666 | Cmme (67) | ✔ | 8 | 68 | 3 | 0.0 | 0.032 | 0.244 | (1;001) | ✗ | 05/01/17 |
| ScAl2Ni | ICSD | 370012 | Cmcm (63) | ✔ | 8 | 54 | 3 | 0.0 | 0.000 | 0.852 | (0;000) | ✗ | 05/01/17 |
| CrCdF6 | COD | 1525283 | R-3 (148) | ✔ | 8 | 68 | 3 | 0.0 | 0.029 | 0.188 | (0;000) | ✗ | 27/01/17 |
| CrP | COD | 9008930 | Pnma (62) | ✔ | 8 | 76 | 3 | 0.0 | 0.000 | 0.480 | (1;011) | ✗ | 27/01/17 |
| HfAl3 | ICSD | 608064 | I4/mmm (139) | ✔ | 8 | 42 | 3 | 0.0 | 0.028 | 0.779 | (1;000) | ✗ | 05/01/17 |
| Al3Ir | ICSD | 608237 | P6_3/mmc (194) | ✔ | 8 | 52 | 3 | 0.0 | 0.001 | 0.542 | (1;000) | ✗ | 05/01/17 |
| Co3Si | ICSD | 625031 | P6_3/mmc (194) | ✔ | 8 | 110 | 3 | 0.0 | 0.000 | 0.688 | (1;000) | ✗ | 27/01/17 |
| YAl3 | ICSD | 58220 | P6_3/mmc (194) | ✔ | 8 | 40 | 3 | 0.0 | 0.010 | 0.518 | (1;000) | ✗ | 05/01/17 |
| ZrAl3 | COD | 2100751 | I4/mmm (139) | ✔ | 8 | 26 | 3 | 0.0 | 0.005 | 0.764 | (0;000) | ✗ | 05/01/17 |
| AlAuO2 | COD | 1531586 | P6_3/mmc (194) | ✔ | 8 | 52 | 3 | 0.5094 | 1.563 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AlAu | COD | 1523318 | P2_1/m (11) | ✔ | 8 | 56 | 3 | 0.0 | 0.126 | 0.308 | (1;000) | ✗ | 05/01/17 |
| HfS3 | ICSD | 638846 | P2_1/m (11) | ✔ | 8 | 60 | 2 | 0.0 | 0.056 | 0.282 | (1;010) | ✗ | 27/01/17 |
| CuCN2 | ICSD | 161460 | Cmcm (63) | ✔ | 8 | 50 | 3 | 0.0 | 0.000 | 0.436 | (0;000) | ✗ | 27/01/17 |
| HfP | ICSD | 42914 | P6_3/mmc (194) | ✔ | 8 | 68 | 3 | 0.0 | 0.034 | 0.345 | (1;000) | ✗ | 27/01/17 |
| RbScO2 | COD | 1528203 | P6_3/mmc (194) | ✔ | 8 | 64 | 2 | 3.4955 | 3.922 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BrF3 | ICSD | 31689 | Ccm2_1 (36) | ✗ | 8 | 56 | 1 | 2.3987 | 2.540 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CrTe | COD | 1525992 | Pnma (62) | ✔ | 8 | 80 | 3 | 0.0 | 0.004 | 0.465 | (1;000) | ✗ | 27/01/17 |
| YHg3 | COD | 1522354 | P6_3/mmc (194) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.689 | (0;000) | ✗ | 27/01/17 |
| ScHg3 | COD | 1522353 | P6_3/mmc (194) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.741 | (0;000) | ✗ | 27/01/17 |
| CsAlO2 | ICSD | 28372 | Fd-3m (227) | ✔ | 8 | 48 | 3 | 4.8428 | 4.850 | 0.000 | (0;000) | ✗ | 05/01/17 |
| TeI | ICSD | 108 | C2/m (12) | ✔ | 8 | 52 | 2 | 0.4247 | 0.727 | 0.000 | (0;000) | ✔ | 06/10/16 |
| LiHg3 | ICSD | 639074 | P6_3/mmc (194) | ✔ | 8 | 78 | 3 | 0.0 | 0.000 | 0.893 | (0;000) | ✗ | 27/01/17 |
| GaFe3 | ICSD | 631740 | P6_3/mmc (194) | ✔ | 8 | 74 | 3 | 0.0 | 0.000 | 0.898 | (0;000) | ✗ | 27/01/17 |
| Cs2MnF5 | ICSD | 69675 | P4/mmm (123) | ✔ | 8 | 68 | 1 | 0.0 | 0.052 | 0.625 | (0;000) | ✗ | 27/01/17 |
| AlCuO2 | COD | 1531583 | P6_3/mmc (194) | ✔ | 8 | 52 | 3 | 1.9892 | 2.478 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AlF3 | COD | 1000467 | R-3c (167) | ✔ | 8 | 48 | 3 | 8.0575 | 8.058 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Fe3Ge | COD | 1001144 | P6_3/mmc (194) | ✔ | 8 | 56 | 3 | 0.0 | 0.000 | 0.549 | (1;000) | ✗ | 27/01/17 |
| PI3 | ICSD | 311 | P2_1 (4) | ✗ | 8 | 52 | 1 | 1.8955 | 1.899 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K2AlF5 | COD | 1000479 | P4/mmm (123) | ✔ | 8 | 56 | 1 | 6.503 | 6.546 | 0.000 | (0;000) | ✗ | 05/01/17 |
| TiI3 | ICSD | 422870 | Cm2m (38) | ✗ | 8 | 66 | 1 | 0.0 | 0.009 | 0.345 | (0;000) | ✔ | 06/10/16 |
| ZrI3 | ICSD | 74648 | Cm2m (38) | ✗ | 8 | 66 | 1 | 0.0 | 0.085 | 0.322 | (0;000) | ✔ | 06/10/16 |
| AlH3 | COD | 4343801 | R-3c (167) | ✔ | 8 | 12 | 3 | 2.287 | 2.372 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Mg3Hg | COD | 1523297 | P6_3/mmc (194) | ✔ | 8 | 84 | 3 | 0.0 | 0.023 | 0.588 | (1;000) | ✗ | 27/01/17 |
| HfAlPt2 | ICSD | 608138 | P6_3/mmc (194) | ✔ | 8 | 70 | 3 | 0.0 | 0.000 | 0.937 | (0;000) | ✗ | 05/01/17 |
| KAlO2 | COD | 2105208 | Fd-3m (227) | ✔ | 8 | 48 | 0 | 3.2866 | 3.290 | 0.000 | (0;000) | ✗ | 05/01/17 |
| LiAl | ICSD | 262069 | P6_3/mmc (194) | ✔ | 8 | 24 | 1 | 0.0 | 0.000 | 0.353 | (0;000) | ✗ | 05/01/17 |
| InRu3 | ICSD | 640342 | P6_3/mmc (194) | ✔ | 8 | 122 | 3 | 0.0 | 0.000 | 0.712 | (1;000) | ✗ | 27/01/17 |
| C | COD | 9012590 | P6_3/mmc (194) | ✔ | 8 | 32 | 3 | 4.4445 | 5.193 | 0.000 | (0;000) | ✗ | 27/01/17 |
| YCd3 | COD | 1524117 | Cmcm (63) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.845 | (1;110) | ✗ | 27/01/17 |
| SrIn2Ir | ICSD | 410401 | Cmcm (63) | ✔ | 8 | 106 | 3 | 0.0 | 0.000 | 0.784 | (0;110) | ✗ | 27/01/17 |