| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| BaFeO3 | ICSD | 262131 | Pm-3m (221) | ✔ | 5 | 36 | 3 | 0.0 | 0.000 | 0.821 | (1;000) | ✗ | 05/01/17 |
| BaMnPF | COD | 7203816 | P4/nmm (129) | ✔ | 8 | 74 | 1 | 0.0 | 0.000 | 0.850 | (0;001) | ✗ | 05/01/17 |
| NaIO2 | COD | 1010624 | I4_1/amd (141) | ✔ | 8 | 56 | 3 | 0.0 | 0.021 | 0.110 | (1;111) | ✗ | 30/01/17 |
| NaIO3 | COD | 9016104 | Cmmm (65) | ✔ | 5 | 34 | 3 | 0.0 | 0.018 | 0.496 | (0;111) | ✗ | 30/01/17 |
| NaIO4 | COD | 1010016 | I4_1/a (88) | ✔ | 12 | 80 | 3 | 0.0 | 0.014 | 0.493 | (1;111) | ✗ | 30/01/17 |
| InCuSe2 | ICSD | 250247 | P1 (1) | ✗ | 8 | 72 | 3 | 0.0 | 0.016 | 0.025 | (1;000) | ✔ | 06/10/16 |
| NaPb2IO6 | ICSD | 427115 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.155 | (0;000) | ✗ | 30/01/17 |
| BaMnSbF | ICSD | 248366 | P4/nmm (129) | ✔ | 8 | 74 | 1 | 0.0 | 0.000 | 0.872 | (0;000) | ✗ | 05/01/17 |
| Ti2H | ICSD | 168323 | Pn-3m (224) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.818 | (1;000) | ✗ | 06/10/16 |
| IN | COD | 9014835 | Fm-3m (225) | ✔ | 2 | 12 | 1 | 0.0 | 0.034 | 0.639 | (0;000) | ✗ | 30/01/17 |
| IN | COD | 9015547 | Pm-3m (221) | ✔ | 2 | 12 | 1 | 0.0 | 0.005 | 0.477 | (1;111) | ✗ | 30/01/17 |
| InPd3 | ICSD | 247188 | I4/mmm (139) | ✔ | 8 | 134 | 3 | 0.0 | 0.039 | 0.307 | (1;000) | ✗ | 30/01/17 |
| Sr2IN | COD | 1528373 | R-3m (166) | ✔ | 4 | 32 | 2 | 0.0 | 0.003 | 0.437 | (1;000) | ✗ | 30/01/17 |
| SiCu2S3 | ICSD | 24132 | Cm (8) | ✗ | 12 | 88 | 3 | 0.0 | 0.014 | 0.457 | ? | ✗ | 06/10/16 |
| BaZnSbF | COD | 7203813 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.0 | 0.028 | 0.046 | (0;000) | ✗ | 05/01/17 |
| BaGa2 | ICSD | 58649 | P6/mmm (191) | ✔ | 3 | 36 | 2 | 0.0 | 0.013 | 0.482 | (1;000) | ✗ | 05/01/17 |
| RbIO3 | COD | 5910051 | Pm-3m (221) | ✔ | 5 | 34 | 3 | 0.0 | 0.017 | 0.103 | (1;111) | ✗ | 30/01/17 |
| BaGa4 | ICSD | 615865 | I4/mmm (139) | ✔ | 5 | 62 | 3 | 0.0 | 0.016 | 0.239 | (1;000) | ✗ | 05/01/17 |
| BaLi2(MgGe)2 | COD | 8101153 | R-3m (166) | ✔ | 7 | 44 | 1 | 0.0 | 0.117 | 0.220 | (0;000) | ✗ | 05/01/17 |
| Ni3Se4 | ICSD | 42558 | C2/m (12) | ✔ | 7 | 54 | 3 | 0.0 | 0.040 | 0.597 | (0;000) | ✔ | 06/10/16 |
| Y3H2 | ICSD | 152861 | P6_3/mmc (194) | ✔ | 10 | 70 | 3 | 0.0 | 0.000 | 0.932 | (0;000) | ✗ | 06/10/16 |
| Ba(MgGe)2 | ICSD | 25312 | I4/mmm (139) | ✔ | 5 | 38 | 3 | 0.0 | 0.014 | 0.260 | (1;111) | ✗ | 05/01/17 |
| Ba(MnGe)2 | ICSD | 404 | I4/mmm (139) | ✔ | 5 | 48 | 3 | 0.0 | 0.001 | 0.733 | (0;000) | ✗ | 05/01/17 |
| BaGe2 | COD | 7221343 | I4_1/amd (141) | ✔ | 6 | 36 | 3 | 0.0 | 0.005 | 0.182 | (1;111) | ✗ | 05/01/17 |
| Ba(GeRh)2 | ICSD | 77146 | I4/mmm (139) | ✔ | 5 | 52 | 2 | 0.0 | 0.009 | 0.573 | (1;000) | ✗ | 05/01/17 |
| HBr | ICSD | 28842 | Fmmm (69) | ✔ | 2 | 8 | 1 | 0.0 | 0.014 | 0.282 | (0;000) | ✗ | 06/10/16 |
| Cu2SnSe3 | ICSD | 247698 | Cc (9) | ✗ | 12 | 108 | 3 | 0.0 | 0.006 | 0.171 | (1;000) | ✔ | 05/12/16 |
| BaMg4Ge3 | COD | 4322260 | P4/mmm (123) | ✔ | 8 | 62 | 3 | 0.0 | 0.005 | 0.308 | (0;001) | ✗ | 05/01/17 |
| BaGe | ICSD | 659524 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.013 | 0.141 | (0;110) | ✗ | 05/01/17 |
| CuAuSe4 | COD | 4331413 | P2_1/m (11) | ✔ | 12 | 92 | 3 | 0.0 | 0.639 | 0.074 | (0;000) | ✗ | 02/02/17 |
| Cu2SnTe3 | ICSD | 160882 | Im2m (44) | ✗ | 6 | 54 | 3 | 0.0 | 0.046 | 0.170 | (1;000) | ✔ | 06/10/16 |
| BaMgGe | COD | 9008328 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 0.0 | 0.001 | 0.176 | (1;001) | ✗ | 05/01/17 |
| BaMnGe | ICSD | 615891 | P4/nmm (129) | ✔ | 6 | 58 | 1 | 0.0 | 0.000 | 0.816 | (0;000) | ✗ | 05/01/17 |
| HCl | ICSD | 28844 | Fmmm (69) | ✔ | 2 | 8 | 1 | 0.0 | 0.033 | 0.154 | (1;000) | ✗ | 06/10/16 |
| NaCu3Te2 | ICSD | 60860 | R3m (160) | ✗ | 6 | 54 | 1 | 0.0 | 0.052 | 0.021 | (0;111) | ✔ | 06/10/16 |
| BaMnGe | COD | 9008362 | P4/nmm (129) | ✔ | 6 | 58 | 1 | 0.0 | 0.000 | 0.812 | (0;001) | ✗ | 05/01/17 |
| BaNi2Ge | ICSD | 421431 | Pmmn (59) | ✔ | 8 | 68 | 3 | 0.0 | 0.035 | 0.272 | (0;010) | ✗ | 05/01/17 |
| BaZnGe | COD | 1527801 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.018 | 0.282 | (0;000) | ✗ | 05/01/17 |
| SrInAu | ICSD | 391422 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.069 | 0.359 | (1;000) | ✗ | 02/02/17 |
| TiH | ICSD | 168325 | P4_2/mmc (131) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.512 | (0;011) | ✗ | 06/10/16 |
| Te2AuI | COD | 1510184 | Pmma (51) | ✔ | 8 | 60 | 3 | 0.0 | 0.059 | 0.239 | (1;010) | ✗ | 02/02/17 |
| BaLiH3 | ICSD | 23977 | Pm-3m (221) | ✔ | 5 | 16 | 3 | 0.0 | 0.003 | 0.111 | (0;111) | ✗ | 05/01/17 |
| SnO | ICSD | 20624 | P2_1mn (31) | ✗ | 4 | 40 | 3 | 0.0 | 0.237 | 0.107 | (0;000) | ✔ | 06/10/16 |
| ZrH | ICSD | 169451 | P4_2/mmc (131) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.564 | (0;011) | ✗ | 06/10/16 |
| HfH2 | ICSD | 24721 | I4/mmm (139) | ✔ | 3 | 14 | 3 | 0.0 | 0.155 | 0.144 | (0;000) | ✗ | 27/01/17 |
| BaHg2 | ICSD | 58655 | Imma (74) | ✔ | 6 | 68 | 3 | 0.0 | 0.037 | 0.399 | (0;111) | ✗ | 05/01/17 |
| BaHg | ICSD | 58654 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.616 | (1;000) | ✗ | 05/01/17 |
| K3Sn4Au | ICSD | 107444 | Pmmn (59) | ✔ | 16 | 188 | 1 | 0.0 | 0.012 | 0.223 | (1;000) | ✗ | 02/02/17 |
| BaSnHg | COD | 1527795 | P6_3/mmc (194) | ✔ | 6 | 72 | 2 | 0.0 | 0.015 | 0.153 | (1;000) | ✗ | 05/01/17 |
| Ba | ICSD | 109028 | I4/mcm (140) | ✔ | 4 | 40 | 1 | 0.0 | 0.002 | 0.515 | (0;000) | ✗ | 05/01/17 |