| ▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sr3V2O8 | ICSD | 167701 | R-3m (166) | ✔ | 13 | 104 | 1 | 4.1826 | 4.367 | 0.000 | (0;000) | ✗ | 27/01/17 |
| O2 | ICSD | 164724 | P6_3/mmc (194) | ✔ | 4 | 24 | 1 | 0.0 | 0.002 | 0.588 | (1;000) | ✗ | 27/01/17 |
| O2 | ICSD | 236857 | C2/m (12) | ✔ | 8 | 48 | 1 | 0.0 | 0.401 | 0.146 | (0;000) | ✗ | 27/01/17 |
| O2 | ICSD | 28530 | P4/mmm (123) | ✔ | 1 | 6 | 1 | 0.0 | 0.025 | 0.322 | (0;000) | ✗ | 27/01/17 |
| Sr(ZnAs)2 | ICSD | 23248 | P-3m1 (164) | ✔ | 5 | 44 | 2 | 0.2109 | 0.211 | 0.000 | (0;000) | ✗ | 05/01/17 |
| O2 | ICSD | 190369 | R-3m (166) | ✔ | 2 | 12 | 1 | 0.0 | 0.027 | 0.525 | (0;000) | ✗ | 27/01/17 |
| Sr4P2O | ICSD | 33903 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 1.2028 | 1.238 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Te3As2 | ICSD | 68110 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.0 | 0.077 | 0.045 | (1;000) | ✗ | 05/01/17 |
| BiTeI | ICSD | 10500 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.255 | (0;000) | ✔ | 06/10/16 |
| CaP3 | ICSD | 74479 | P-1 (2) | ✔ | 8 | 50 | 1 | 0.0 | 0.016 | 0.024 | (1;010) | ✗ | 27/01/17 |
| BiTeI | ICSD | 263109 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.1819 | 0.182 | 0.000 | (0;000) | ✔ | 06/10/16 |
| LiN3 | ICSD | 34675 | C2/m (12) | ✔ | 4 | 18 | 1 | 3.7952 | 4.288 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Pd2O | ICSD | 77651 | Pn-3m (224) | ✔ | 6 | 84 | 3 | 0.0 | 0.000 | 0.351 | (0;111) | ✗ | 27/01/17 |
| PdO | ICSD | 41617 | I4/mmm (139) | ✔ | 2 | 24 | 3 | 0.0 | 0.011 | 0.625 | (0;000) | ✗ | 27/01/17 |
| BiTeI | ICSD | 74501 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.003 | 0.261 | (0;000) | ✔ | 06/10/16 |
| PdO | ICSD | 77650 | Fm-3m (225) | ✔ | 2 | 24 | 1 | 0.0 | 0.000 | 0.599 | (0;000) | ✗ | 27/01/17 |
| Mo2As3 | ICSD | 43184 | C2/m (12) | ✔ | 10 | 86 | 3 | 0.0 | 0.017 | 0.254 | (0;111) | ✗ | 05/01/17 |
| PtO | ICSD | 164290 | P4_2/mmc (131) | ✔ | 4 | 32 | 3 | 0.0 | 0.001 | 0.128 | (0;000) | ✗ | 27/01/17 |
| K2Se3 | ICSD | 1264 | Ccm2_1 (36) | ✗ | 10 | 72 | 1 | 0.7025 | 0.851 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaSi | ICSD | 190659 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.007 | 0.172 | (1;000) | ✗ | 06/10/16 |
| BiTeI | ICSD | 79364 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.006 | (1;100) | ✔ | 06/10/16 |
| Sr(POs)2 | ICSD | 602096 | I4/mmm (139) | ✔ | 5 | 52 | 2 | 0.0 | 0.004 | 0.626 | (1;111) | ✗ | 27/01/17 |
| ScOs2 | ICSD | 647766 | P6_3/mmc (194) | ✔ | 12 | 172 | 3 | 0.0 | 0.004 | 0.938 | (1;000) | ✗ | 27/01/17 |
| ZrOs2 | ICSD | 647879 | P6_3/mmc (194) | ✔ | 12 | 144 | 3 | 0.0 | 0.006 | 0.477 | (1;000) | ✗ | 27/01/17 |
| ZrSiO | ICSD | 25731 | P4/nmm (129) | ✔ | 6 | 28 | 2 | 0.0 | 0.041 | 0.027 | (0;001) | ✗ | 27/01/17 |
| Mo5As4 | ICSD | 43187 | I4/m (87) | ✔ | 9 | 90 | 3 | 0.0 | 0.001 | 0.537 | (1;000) | ✗ | 05/01/17 |
| Mo5As4 | ICSD | 610956 | I4/m (87) | ✔ | 9 | 90 | 3 | 0.0 | 0.001 | 0.847 | (1;111) | ✗ | 05/01/17 |
| InBiS3 | ICSD | 290195 | P2_1 (4) | ✗ | 10 | 72 | 3 | 0.8716 | 1.031 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BaAsAu | ICSD | 420341 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.000 | 0.046 | (1;000) | ✗ | 05/01/17 |
| CaAsAu | ICSD | 107915 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.020 | 0.040 | (1;000) | ✗ | 05/01/17 |
| POsSe | ICSD | 647716 | P2_1/c (14) | ✔ | 12 | 108 | 3 | 0.762 | 1.054 | 0.000 | (0;000) | ✗ | 27/01/17 |
| POsS | ICSD | 647714 | P2_1/c (14) | ✔ | 12 | 108 | 3 | 0.8312 | 1.100 | 0.000 | (0;000) | ✗ | 27/01/17 |
| ZrPOs | ICSD | 647720 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.001 | 0.549 | (1;011) | ✗ | 27/01/17 |
| TiSi2 | ICSD | 168418 | Cmcm (63) | ✔ | 6 | 40 | 3 | 0.0 | 0.009 | 0.350 | (0;110) | ✗ | 27/01/17 |
| ScAl3 | ICSD | 107878 | Pm-3m (221) | ✔ | 4 | 20 | 3 | 0.0 | 0.000 | 0.463 | (0;111) | ✗ | 05/01/17 |
| Na2AsAu | ICSD | 23254 | Cmcm (63) | ✔ | 8 | 68 | 1 | 0.2318 | 0.248 | 0.000 | (0;000) | ✗ | 05/01/17 |
| ZrSiOs | ICSD | 647807 | Pnma (62) | ✔ | 12 | 96 | 3 | 0.0 | 0.055 | 0.317 | (1;000) | ✗ | 27/01/17 |
| B6As | ICSD | 107916 | R-3m (166) | ✔ | 14 | 46 | 3 | 2.5791 | 2.612 | 0.000 | (0;000) | ✗ | 05/01/17 |
| ZrSO | ICSD | 36111 | P4/nmm (129) | ✔ | 6 | 32 | 3 | 0.8081 | 0.808 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Li5BiO5 | ICSD | 203031 | Cm (8) | ✗ | 11 | 50 | 2 | 1.5359 | 1.767 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ti2O | ICSD | 24081 | P-3m1 (164) | ✔ | 3 | 30 | 3 | 0.0 | 0.025 | 0.314 | (0;000) | ✗ | 27/01/17 |
| BaCdAsF | ICSD | 189938 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.8914 | 0.891 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Ti3O | ICSD | 23575 | P-31m (162) | ✔ | 8 | 84 | 3 | 0.0 | 0.003 | 0.542 | (0;001) | ✗ | 27/01/17 |
| Ti6O | ICSD | 20042 | P-31m (162) | ✔ | 7 | 78 | 3 | 0.0 | 0.003 | 0.638 | (1;001) | ✗ | 27/01/17 |
| BaCuAs | ICSD | 41705 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.0 | 0.214 | 0.134 | (0;000) | ✗ | 05/01/17 |
| Zr2O | ICSD | 77714 | Pn-3m (224) | ✔ | 6 | 28 | 3 | 0.0 | 0.000 | 0.564 | (0;111) | ✗ | 27/01/17 |
| Zr3O | ICSD | 27023 | R-3c (167) | ✔ | 8 | 36 | 3 | 0.0 | 0.010 | 0.240 | (1;000) | ✗ | 27/01/17 |
| CdC | ICSD | 183178 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.000 | 0.842 | (0;000) | ✔ | 06/10/16 |
| Sr(PPd)2 | ICSD | 36373 | I4/mmm (139) | ✔ | 5 | 56 | 2 | 0.0 | 0.055 | 0.807 | (1;000) | ✗ | 27/01/17 |
| LaS | ICSD | 69581 | Cm2e (39) | ✗ | 4 | 18 | 2 | 0.0 | 0.001 | 0.772 | (0;010) | ✔ | 06/10/16 |