| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| NiSbS | ICSD | 44606 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.571 | ? | ✗ | 06/10/16 |
| CoSiNi | ICSD | 165256 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.000 | 0.473 | (0;011) | ✗ | 27/01/17 |
| LiCaN | ICSD | 107304 | Pnma (62) | ✔ | 12 | 72 | 1 | 1.437 | 1.437 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NbCoP | ICSD | 624292 | Pnma (62) | ✔ | 12 | 140 | 3 | 0.0 | 0.001 | 0.385 | (1;011) | ✗ | 27/01/17 |
| SnICl | ICSD | 23262 | Pnma (62) | ✔ | 12 | 112 | 1 | 2.1913 | 2.256 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Li2ReO3 | ICSD | 200999 | R3c (161) | ✗ | 12 | 78 | 3 | 0.0 | 0.001 | 0.327 | (0;111) | ✔ | 05/12/16 |
| Li2SiO3 | ICSD | 100402 | Ccm2_1 (36) | ✗ | 12 | 56 | 1 | 5.3828 | 5.687 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ba2Ge | ICSD | 25351 | Pnma (62) | ✔ | 12 | 96 | 1 | 0.0 | 0.008 | 0.019 | (1;000) | ✗ | 02/02/17 |
| Na2PS3 | ICSD | 426907 | C2/m (12) | ✔ | 12 | 82 | 1 | 2.7557 | 3.066 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Li2SiO3 | ICSD | 16626 | Ccm2_1 (36) | ✗ | 12 | 56 | 1 | 4.9814 | 5.208 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na2ZrSe3 | ICSD | 412158 | C2/m (12) | ✔ | 12 | 80 | 2 | 1.0681 | 1.371 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Li2SiO3 | ICSD | 28192 | Ccm2_1 (36) | ✗ | 12 | 56 | 2 | 5.2008 | 5.421 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na2S | COD | 2106220 | Pnma (62) | ✔ | 12 | 96 | 1 | 2.6588 | 2.659 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Li2SiO3 | ICSD | 853 | Ccm2_1 (36) | ✗ | 12 | 56 | 1 | 5.3811 | 5.691 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ba2In | ICSD | 261714 | Pnma (62) | ✔ | 12 | 132 | 1 | 0.0 | 0.000 | 0.462 | (1;011) | ✗ | 02/02/17 |
| Li2ZrO3 | ICSD | 31941 | Cc (9) | ✗ | 12 | 56 | 3 | 3.6749 | 3.930 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaMoO4 | COD | 9009638 | I4_1/a (88) | ✔ | 12 | 96 | 1 | 3.4169 | 3.417 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SiAs | ICSD | 153457 | C2/m (12) | ✔ | 12 | 54 | 3 | 0.8022 | 0.969 | 0.000 | (0;000) | ✗ | 30/01/17 |
| YNbO4 | COD | 9011436 | C2/c (15) | ✔ | 12 | 96 | 3 | 3.6266 | 3.747 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Nb4SiNi | ICSD | 76559 | P4/mcc (124) | ✔ | 12 | 132 | 3 | 0.0 | 0.004 | 0.349 | (1;110) | ✗ | 27/01/17 |
| YF3 | COD | 1011296 | Pm-3m (221) | ✔ | 12 | 96 | 3 | 4.7827 | 4.951 | 0.000 | (0;000) | ✗ | 27/01/17 |
| PbICl | ICSD | 22137 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.9909 | 2.048 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NbSiNi | ICSD | 645107 | Pnma (62) | ✔ | 12 | 108 | 3 | 0.0 | 0.001 | 0.382 | (1;011) | ✗ | 27/01/17 |
| Mg2PN3 | ICSD | 27229 | Cmc2_1 (36) | ✗ | 12 | 80 | 3 | 3.1755 | 3.176 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NbNiP | ICSD | 645088 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.013 | 0.279 | (0;000) | ✗ | 27/01/17 |
| SnBr2 | ICSD | 411177 | Pnma (62) | ✔ | 12 | 112 | 1 | 2.2341 | 2.269 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Mg2PN3 | ICSD | 50224 | Cmc2_1 (36) | ✗ | 12 | 80 | 3 | 3.7075 | 4.301 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ba2Pb | ICSD | 416561 | Pnma (62) | ✔ | 12 | 136 | 1 | 0.0261 | 0.029 | 0.000 | (1;000) | ✗ | 02/02/17 |
| NaTl3(SO3)2 | ICSD | 1626 | P-3m1 (164) | ✔ | 12 | 96 | 1 | 3.0547 | 3.215 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Hg2P3Cl | ICSD | 74771 | C2/c (15) | ✔ | 12 | 92 | 3 | 1.102 | 1.651 | 0.000 | (0;000) | ✗ | 02/02/17 |
| PbBr2 | COD | 9009196 | Pnma (62) | ✔ | 12 | 112 | 2 | 2.537 | 2.640 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CaSO4 | COD | 5000040 | Cmcm (63) | ✔ | 12 | 80 | 1 | 6.2076 | 6.694 | 0.000 | (0;000) | ✗ | 27/01/17 |
| GaTeCl | COD | 7221395 | Pnnm (58) | ✔ | 12 | 104 | 2 | 2.0533 | 2.053 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ba2Sn | ICSD | 416562 | Pnma (62) | ✔ | 12 | 136 | 1 | 0.0388 | 0.039 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SnClF | ICSD | 647 | Pnma (62) | ✔ | 12 | 112 | 2 | 3.2601 | 3.299 | 0.000 | (0;000) | ✗ | 02/02/17 |
| HfGeO4 | COD | 1001684 | I4_1/a (88) | ✔ | 12 | 80 | 3 | 4.3629 | 4.433 | 0.000 | (0;000) | ✗ | 27/01/17 |
| HfNiGe | ICSD | 636577 | Pnma (62) | ✔ | 12 | 104 | 3 | 0.0 | 0.038 | 0.196 | (1;000) | ✗ | 27/01/17 |
| Ba2Si | ICSD | 52698 | Pnma (62) | ✔ | 12 | 96 | 1 | 0.0 | 0.011 | 0.022 | (1;000) | ✗ | 02/02/17 |
| HfGeIr | ICSD | 636558 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.002 | 0.447 | (1;011) | ✗ | 27/01/17 |
| BF2 | ICSD | 27867 | P2_1/c (14) | ✔ | 12 | 68 | 1 | 5.0014 | 5.057 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NbVP | ICSD | 645178 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.000 | 0.707 | (0;011) | ✗ | 27/01/17 |
| KFeF4 | ICSD | 23588 | Cmcm (63) | ✔ | 12 | 90 | 1 | 0.0 | 0.001 | 0.935 | (0;000) | ✗ | 27/01/17 |
| Si3MoPt2 | ICSD | 174199 | Pm2_1b (26) | ✗ | 12 | 92 | 3 | 0.0 | 0.007 | 0.557 | ? | ✗ | 06/10/16 |
| Na2CO3 | COD | 9011304 | C2/m (12) | ✔ | 12 | 80 | 1 | 3.9041 | 3.923 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NbPRh | ICSD | 645173 | Pnma (62) | ✔ | 12 | 140 | 3 | 0.0 | 0.001 | 0.444 | (1;011) | ✗ | 27/01/17 |
| NbSiPd | ICSD | 416177 | Pnma (62) | ✔ | 12 | 140 | 3 | 0.0 | 0.001 | 0.448 | (1;011) | ✗ | 27/01/17 |
| Na2CO3 | ICSD | 81004 | P6_3/mmc (194) | ✔ | 12 | 80 | 1 | 2.6517 | 2.652 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Nb2Se | ICSD | 26183 | C2/m (12) | ✔ | 12 | 128 | 3 | 0.0 | 0.015 | 0.279 | (0;111) | ✗ | 02/02/17 |
| NbPRu | ICSD | 645175 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.041 | 0.110 | (0;000) | ✗ | 27/01/17 |
| HfGeRh | ICSD | 636582 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.001 | 0.466 | (1;011) | ✗ | 27/01/17 |