| ▹ Formula | ▹ Source | ▹ ID | ▴ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| SrZnF4 | COD | 1529059 | I4_1/a (88) | ✔ | 12 | 100 | 1 | 5.1177 | 5.118 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TlCl2 | ICSD | 4031 | I4_1/a (88) | ✔ | 12 | 108 | 1 | 2.4354 | 2.536 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ca(AuO2)2 | COD | 7209402 | I4_1/a (88) | ✔ | 14 | 112 | 3 | 1.6019 | 1.602 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Sr(AuO2)2 | COD | 1510452 | I4_1/a (88) | ✔ | 14 | 112 | 3 | 1.6058 | 1.644 | 0.000 | (0;000) | ✗ | 05/01/17 |
| VBiO4 | COD | 9012062 | I4_1/a (88) | ✔ | 12 | 104 | 3 | 2.1086 | 2.165 | 0.000 | (0;000) | ✗ | 05/01/17 |
| YCrO4 | ICSD | 157934 | I4_1/a (88) | ✔ | 12 | 98 | 3 | 0.0 | 0.000 | 0.671 | (1;111) | ✗ | 27/01/17 |
| CaZnF4 | COD | 1529060 | I4_1/a (88) | ✔ | 12 | 100 | 1 | 5.3128 | 5.313 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CaMoO4 | COD | 9009638 | I4_1/a (88) | ✔ | 12 | 96 | 1 | 3.4169 | 3.417 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiScF4 | ICSD | 413966 | I4_1/a (88) | ✔ | 12 | 84 | 3 | 6.3135 | 6.319 | 0.000 | (0;000) | ✗ | 27/01/17 |
| HfGeO4 | COD | 1001684 | I4_1/a (88) | ✔ | 12 | 80 | 3 | 4.3629 | 4.433 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CdMoO4 | COD | 1001800 | I4_1/a (88) | ✔ | 12 | 100 | 3 | 2.5086 | 2.554 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Sn4Rh | ICSD | 174219 | I4_1/acd (142) | ✔ | 20 | 292 | 3 | 0.0 | 0.001 | 0.550 | (1;111) | ✗ | 29/03/17 |
| Sn4Ir | ICSD | 412573 | I4_1/acd (142) | ✔ | 20 | 292 | 3 | 0.0 | 0.003 | 0.491 | (1;111) | ✗ | 29/03/17 |
| KC | COD | 1521141 | I4_1/acd (142) | ✔ | 16 | 104 | 1 | 3.3837 | 3.412 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaC | COD | 1521140 | I4_1/acd (142) | ✔ | 16 | 104 | 1 | 3.5905 | 3.703 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaI | COD | 9015919 | I4_1/amd (141) | ✔ | 4 | 32 | 1 | 1.0237 | 1.101 | 0.000 | (0;000) | ✗ | 30/01/17 |
| HfGa2 | COD | 1522868 | I4_1/amd (141) | ✔ | 12 | 152 | 3 | 0.0 | 0.032 | 0.505 | (1;111) | ✗ | 02/02/17 |
| KP | COD | 9016510 | I4_1/amd (141) | ✔ | 4 | 28 | 1 | 0.0 | 0.015 | 0.048 | (1;111) | ✗ | 27/01/17 |
| V2PO5 | ICSD | 79681 | I4_1/amd (141) | ✔ | 16 | 122 | 3 | 0.0 | 0.000 | 0.725 | (1;111) | ✗ | 27/01/17 |
| Ni(RhO2)2 | ICSD | 23487 | I4_1/amd (141) | ✔ | 14 | 136 | 3 | 0.0 | 0.001 | 0.403 | (1;111) | ✗ | 27/01/17 |
| ScVO4 | COD | 4501809 | I4_1/amd (141) | ✔ | 12 | 96 | 3 | 2.6191 | 2.619 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Mn2ZnO4 | COD | 9012842 | I4_1/amd (141) | ✔ | 14 | 132 | 3 | 0.0 | 0.011 | 0.430 | (1;111) | ✗ | 27/01/17 |
| V2H | ICSD | 61422 | I4_1/amd (141) | ✔ | 12 | 108 | 3 | 0.0 | 0.003 | 0.756 | (1;111) | ✗ | 27/01/17 |
| YPO4 | COD | 9001654 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 5.9664 | 6.176 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SrSi2 | COD | 1527358 | I4_1/amd (141) | ✔ | 6 | 36 | 3 | 0.0 | 0.014 | 0.249 | (1;111) | ✗ | 27/01/17 |
| CsReO4 | ICSD | 72817 | I4_1/amd (141) | ✔ | 12 | 96 | 1 | 4.7877 | 4.788 | 0.000 | (0;000) | ✗ | 02/02/17 |
| MgAl2 | ICSD | 608412 | I4_1/amd (141) | ✔ | 12 | 64 | 3 | 0.0 | 0.016 | 0.882 | (1;111) | ✗ | 30/01/17 |
| ZrSiO4 | COD | 9002561 | I4_1/amd (141) | ✔ | 12 | 64 | 3 | 4.4361 | 4.633 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Mn | ICSD | 163245 | I4_1/amd (141) | ✔ | 2 | 30 | 3 | 0.0 | 0.000 | 0.841 | (1;111) | ✗ | 27/01/17 |
| LiTiO2 | ICSD | 164158 | I4_1/amd (141) | ✔ | 8 | 54 | 3 | 0.0 | 0.000 | 0.622 | (1;111) | ✗ | 27/01/17 |
| Mo2N | ICSD | 30593 | I4_1/amd (141) | ✔ | 6 | 66 | 3 | 0.0 | 0.000 | 0.793 | (1;111) | ✗ | 02/02/17 |
| Sn | COD | 9008570 | I4_1/amd (141) | ✔ | 2 | 28 | 3 | 0.0 | 0.083 | 0.441 | (1;111) | ✗ | 27/01/17 |
| ZrSi | ICSD | 31084 | I4_1/amd (141) | ✔ | 4 | 16 | 3 | 0.0 | 0.000 | 0.536 | (1;111) | ✗ | 27/01/17 |
| YVO4 | COD | 9009764 | I4_1/amd (141) | ✔ | 12 | 96 | 3 | 2.9575 | 2.958 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NbP | COD | 9008973 | I4_1/amd (141) | ✔ | 4 | 36 | 3 | 0.0 | 0.011 | 0.453 | (1;111) | ✗ | 27/01/17 |
| HfSiO4 | COD | 9000852 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 5.4533 | 5.848 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiInO2 | ICSD | 639886 | I4_1/amd (141) | ✔ | 8 | 56 | 3 | 1.4431 | 1.809 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ca(CO)4 | ICSD | 248078 | I4_1/amd (141) | ✔ | 18 | 100 | 1 | 4.1602 | 4.205 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ReB | COD | 1511506 | I4_1/amd (141) | ✔ | 16 | 144 | 3 | 0.0 | 0.003 | 0.609 | (1;111) | ✗ | 02/02/17 |
| YSi2 | ICSD | 150662 | I4_1/amd (141) | ✔ | 6 | 38 | 3 | 0.0 | 0.000 | 0.683 | (1;111) | ✗ | 27/01/17 |
| LiTlO2 | ICSD | 33633 | I4_1/amd (141) | ✔ | 8 | 56 | 3 | 0.1194 | 1.173 | 0.000 | (0;000) | ✗ | 27/01/17 |
| AuBr | COD | 1510609 | I4_1/amd (141) | ✔ | 8 | 72 | 3 | 1.431 | 1.431 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Pb(CO)4 | ICSD | 248144 | I4_1/amd (141) | ✔ | 18 | 108 | 3 | 3.0547 | 3.410 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ScPO4 | COD | 2310638 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 4.4694 | 4.641 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Sr | COD | 9011726 | I4_1/amd (141) | ✔ | 2 | 20 | 1 | 0.0 | 0.003 | 0.174 | (1;111) | ✗ | 27/01/17 |
| LiScO2 | ICSD | 36124 | I4_1/amd (141) | ✔ | 8 | 52 | 3 | 3.951 | 3.968 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NaIO2 | COD | 1010624 | I4_1/amd (141) | ✔ | 8 | 56 | 3 | 0.0 | 0.021 | 0.110 | (1;111) | ✗ | 30/01/17 |
| CsS | ICSD | 38566 | I4_1/amd (141) | ✔ | 4 | 30 | 1 | 0.0 | 0.000 | 0.529 | (1;111) | ✗ | 02/02/17 |
| Li2Sn2Au | ICSD | 192982 | I4_1/amd (141) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.914 | (1;111) | ✗ | 02/02/17 |
| CsBrO4 | COD | 4031454 | I4_1/amd (141) | ✔ | 12 | 80 | 1 | 3.8217 | 3.822 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb | ICSD | 109018 | I4_1/amd (141) | ✔ | 2 | 18 | 3 | 0.0 | 0.000 | 0.554 | (1;111) | ✗ | 27/01/17 |
| TiO2 | COD | 9008216 | I4_1/amd (141) | ✔ | 6 | 48 | 3 | 2.1406 | 2.472 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TaP | COD | 9008974 | I4_1/amd (141) | ✔ | 4 | 36 | 3 | 0.0 | 0.009 | 0.478 | (1;111) | ✗ | 27/01/17 |
| Cl2O | ICSD | 407768 | I4_1/amd (141) | ✔ | 12 | 80 | 1 | 1.1441 | 1.193 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Pd2Cl2O | ICSD | 61333 | I4_1/amd (141) | ✔ | 10 | 112 | 3 | 0.8284 | 1.027 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiFeO2 | ICSD | 31149 | I4_1/amd (141) | ✔ | 8 | 46 | 3 | 0.0 | 0.000 | 0.787 | (1;111) | ✗ | 27/01/17 |
| Cu2Ag2O3 | COD | 1509784 | I4_1/amd (141) | ✔ | 14 | 124 | 3 | 0.0 | 0.008 | 0.587 | (0;000) | ✗ | 05/01/17 |
| LiAg | ICSD | 247145 | I4_1/amd (141) | ✔ | 4 | 28 | 3 | 0.0 | 0.025 | 0.646 | (1;111) | ✗ | 05/01/17 |
| Cu2GeO4 | COD | 1524532 | I4_1/amd (141) | ✔ | 14 | 100 | 3 | 0.0 | 0.001 | 0.845 | (1;111) | ✗ | 27/01/17 |
| Cs | ICSD | 150187 | I4_1/amd (141) | ✔ | 2 | 18 | 3 | 0.0 | 0.000 | 0.599 | (1;111) | ✗ | 27/01/17 |
| Mg2NF | COD | 1528308 | I4_1/amd (141) | ✔ | 8 | 64 | 3 | 0.0 | 0.039 | 0.077 | (1;111) | ✗ | 27/01/17 |
| Sr(CuO)2 | ICSD | 25002 | I4_1/amd (141) | ✔ | 10 | 88 | 3 | 1.8259 | 1.826 | 0.000 | (0;000) | ✗ | 27/01/17 |
| ScAsO4 | ICSD | 155920 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 4.1602 | 4.160 | 0.000 | (0;000) | ✗ | 05/01/17 |
| YAsO4 | COD | 1010919 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 3.2433 | 3.280 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AuCl | ICSD | 6052 | I4_1/amd (141) | ✔ | 8 | 72 | 3 | 1.1538 | 1.154 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Mg2NF | ICSD | 262327 | I4_1/amd (141) | ✔ | 8 | 64 | 3 | 2.2789 | 2.355 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Cu4O3 | COD | 9000603 | I4_1/amd (141) | ✔ | 14 | 124 | 3 | 0.0 | 0.025 | 0.679 | (1;111) | ✗ | 27/01/17 |
| Ba(CuO)2 | COD | 2002215 | I4_1/amd (141) | ✔ | 10 | 88 | 3 | 1.3364 | 1.336 | 0.000 | (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 |
| Li2BF5 | ICSD | 426821 | I4_1/amd (141) | ✔ | 16 | 88 | 1 | 7.2587 | 7.289 | 0.000 | (0;000) | ✗ | 05/01/17 |
| VBiO4 | COD | 9011741 | I4_1/amd (141) | ✔ | 12 | 104 | 3 | 2.5386 | 2.543 | 0.000 | (0;000) | ✗ | 05/01/17 |
| BMo | COD | 9008953 | I4_1/amd (141) | ✔ | 8 | 68 | 3 | 0.0 | 0.032 | 0.690 | (1;111) | ✗ | 27/01/17 |
| NbBO4 | COD | 9012847 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 2.8207 | 2.846 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TaBO4 | COD | 1511288 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 3.5135 | 3.581 | 0.000 | (0;000) | ✗ | 27/01/17 |
| ZrGa | COD | 1522708 | I4_1/amd (141) | ✔ | 8 | 68 | 3 | 0.0 | 0.004 | 0.747 | (1;111) | ✗ | 27/01/17 |
| YCrO4 | COD | 1008143 | I4_1/amd (141) | ✔ | 12 | 98 | 3 | 0.0 | 0.000 | 0.930 | (1;111) | ✗ | 27/01/17 |
| CaCrO4 | COD | 1010939 | I4_1/amd (141) | ✔ | 12 | 96 | 1 | 2.8326 | 2.833 | 0.000 | (0;000) | ✗ | 27/01/17 |
| YGe2 | ICSD | 76344 | I4_1/amd (141) | ✔ | 6 | 38 | 3 | 0.0 | 0.000 | 0.648 | (1;111) | ✗ | 27/01/17 |
| CaIn2O4 | ICSD | 52390 | I4_1/amd (141) | ✔ | 14 | 120 | 3 | 2.1818 | 2.208 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Cu(RhO2)2 | COD | 2006191 | I4_1/amd (141) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.780 | (1;111) | ✗ | 27/01/17 |
| CaSi2 | ICSD | 248532 | I4_1/amd (141) | ✔ | 6 | 36 | 3 | 0.0 | 0.003 | 0.257 | (1;111) | ✗ | 27/01/17 |
| CaW | ICSD | 28952 | I4_1/amd (141) | ✔ | 4 | 48 | 1 | 0.0 | 0.019 | 0.278 | (1;111) | ✗ | 27/01/17 |
| HfGe | COD | 9016210 | I4_1/amd (141) | ✔ | 4 | 32 | 3 | 0.0 | 0.002 | 0.343 | (1;111) | ✗ | 27/01/17 |
| Mn2CdO4 | ICSD | 24258 | I4_1/amd (141) | ✔ | 14 | 132 | 3 | 0.0 | 0.012 | 0.586 | (1;111) | ✗ | 27/01/17 |
| Ge | ICSD | 636530 | I4_1/amd (141) | ✔ | 2 | 8 | 3 | 0.0 | 0.027 | 0.455 | (1;111) | ✗ | 27/01/17 |
| Li2CuSn2 | ICSD | 426084 | I4_1/amd (141) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.933 | (1;111) | ✗ | 22/03/17 |
| TiAl2 | ICSD | 107009 | I4_1/amd (141) | ✔ | 12 | 72 | 3 | 0.0 | 0.003 | 0.599 | (1;111) | ✗ | 16/03/17 |
| ZrIn2 | ICSD | 640720 | I4_1/amd (141) | ✔ | 12 | 120 | 3 | 0.0 | 0.016 | 0.551 | (1;111) | ✗ | 29/03/17 |
| CrB | ICSD | 613476 | I4_1/amd (141) | ✔ | 8 | 68 | 3 | 0.0 | 0.005 | 0.669 | (1;111) | ✗ | 21/03/17 |
| HgI2 | COD | 9008155 | I4_1/amd (141) | ✔ | 24 | 208 | 3 | 1.2969 | 1.297 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SrLi4N2 | ICSD | 87413 | I4_1/amd (141) | ✔ | 14 | 64 | 1 | 0.9167 | 1.149 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Ca4In2N | ICSD | 62535 | I4_1/amd (141) | ✔ | 14 | 142 | 1 | 0.0 | 0.000 | 0.958 | (1;111) | ✗ | 21/03/17 |
| CsH3O2 | COD | 2012559 | I4_1/amd (141) | ✔ | 12 | 48 | 3 | 4.5945 | 4.737 | 0.000 | (0;000) | ✗ | 22/03/17 |
| BW | COD | 9008954 | I4_1/amd (141) | ✔ | 8 | 68 | 3 | 0.0 | 0.008 | 1.000 | (1;111) | ✗ | 21/03/17 |
| Li3BN2 | ICSD | 155127 | I4_1/amd (141) | ✔ | 24 | 88 | 1 | 3.346 | 3.346 | 0.000 | (0;000) | ✗ | 04/08/17 |
| LiGe | ICSD | 60843 | I4_1/amd (141) | ✔ | 12 | 42 | 1 | 0.0 | 0.000 | 0.849 | (1;111) | ✗ | 22/03/17 |
| Sr4In2N | ICSD | 62536 | I4_1/amd (141) | ✔ | 14 | 142 | 1 | 0.0 | 0.000 | 0.891 | (1;111) | ✗ | 29/03/17 |
| ScSn2 | ICSD | 106965 | I4_1/amd (141) | ✔ | 12 | 156 | 3 | 0.0 | 0.007 | 0.811 | (1;111) | ✗ | 29/03/17 |
| LiSn | ICSD | 107516 | I4_1/amd (141) | ✔ | 12 | 102 | 3 | 0.0 | 0.000 | 0.856 | (1;111) | ✗ | 29/03/17 |
| TiGa2 | ICSD | 635561 | I4_1/amd (141) | ✔ | 12 | 152 | 3 | 0.0 | 0.005 | 0.600 | (1;111) | ✗ | 22/03/17 |