| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▴ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Nb3Bi | ICSD | 58817 | Pm-3n (223) | ✔ | 8 | 108 | 3 | 0.0 | 0.000 | 0.263 | (1;000) | ✗ | 05/01/17 |
| AgO | COD | 2310065 | C2/c (15) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.283 | (1;010) | ✗ | 05/01/17 |
| Zr3AlN | ICSD | 29521 | Cmcm (63) | ✔ | 10 | 40 | 3 | 0.0 | 0.000 | 0.916 | (0;000) | ✗ | 05/01/17 |
| NaCl3 | ICSD | 190539 | Pm-3n (223) | ✔ | 8 | 60 | 3 | 0.0 | 0.000 | 0.607 | (1;111) | ✗ | 27/01/17 |
| FeBiO3 | ICSD | 186955 | R3c (161) | ✗ | 10 | 62 | 3 | 0.0 | 0.000 | 0.549 | ? | ✗ | 06/10/16 |
| Cu5As2 | COD | 9012384 | Ibam (72) | ✔ | 14 | 130 | 3 | 0.0 | 0.000 | 0.547 | (0;111) | ✗ | 05/01/17 |
| Cu2H3ClO3 | COD | 9007603 | R-3m (166) | ✔ | 18 | 100 | 3 | 0.0 | 0.000 | 0.621 | (1;000) | ✗ | 27/01/17 |
| CrP | ICSD | 42079 | Pmnb (62) | ✔ | 8 | 76 | 3 | 0.0 | 0.000 | 0.349 | (1;011) | ✗ | 06/10/16 |
| Al6C3N2 | ICSD | 654993 | R3m (160) | ✗ | 11 | 40 | 3 | 0.0 | 0.000 | 0.475 | (0;000) | ✔ | 06/10/16 |
| NiF3 | ICSD | 87943 | R-3 (148) | ✔ | 8 | 62 | 3 | 0.0 | 0.000 | 0.663 | (0;000) | ✗ | 27/01/17 |
| TiCo2Sn | COD | 1525529 | Fm-3m (225) | ✔ | 4 | 60 | 3 | 0.0 | 0.000 | 0.685 | (0;000) | ✗ | 27/01/17 |
| Ni4B3 | ICSD | 150561 | C2/c (15) | ✔ | 14 | 98 | 3 | 0.0 | 0.000 | 0.801 | (0;100) | ✗ | 05/01/17 |
| ZrCoGe | ICSD | 623685 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.000 | 0.636 | (1;011) | ✗ | 27/01/17 |
| Zr2PbC | ICSD | 618634 | P6_3/mmc (194) | ✔ | 8 | 52 | 3 | 0.0 | 0.000 | 0.563 | (1;000) | ✗ | 27/01/17 |
| TiBO3 | COD | 8103469 | R-3c (167) | ✔ | 10 | 66 | 3 | 0.0 | 0.000 | 0.815 | (0;000) | ✗ | 27/01/17 |
| CrP | COD | 9008930 | Pnma (62) | ✔ | 8 | 76 | 3 | 0.0 | 0.000 | 0.480 | (1;011) | ✗ | 27/01/17 |
| CrSe | ICSD | 24792 | P6_3/mmc (194) | ✔ | 4 | 40 | 3 | 0.0 | 0.000 | 0.586 | (1;000) | ✔ | 06/10/16 |
| TiCuGe | ICSD | 53283 | Pnma (62) | ✔ | 12 | 108 | 3 | 0.0 | 0.000 | 0.454 | (1;011) | ✗ | 27/01/17 |
| Ba(AlSi)2 | ICSD | 153385 | I4/mmm (139) | ✔ | 5 | 24 | 2 | 0.0 | 0.000 | 0.319 | (1;000) | ✗ | 05/01/17 |
| Fe2B | COD | 1010474 | I4/mcm (140) | ✔ | 6 | 38 | 3 | 0.0 | 0.000 | 0.524 | (1;001) | ✗ | 27/01/17 |
| Fe2NiO4 | ICSD | 52387 | Fd-3m (227) | ✔ | 14 | 100 | 3 | 0.0 | 0.000 | 0.790 | (0;000) | ✗ | 27/01/17 |
| FeMoP | ICSD | 632646 | Pnma (62) | ✔ | 12 | 108 | 3 | 0.0 | 0.000 | 0.423 | (0;011) | ✗ | 27/01/17 |
| NiSnF6 | ICSD | 25015 | R-3 (148) | ✔ | 8 | 66 | 3 | 0.0 | 0.000 | 0.415 | (0;000) | ✗ | 27/01/17 |
| MnCuAs | ICSD | 72413 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.000 | 0.258 | (1;011) | ✗ | 05/01/17 |
| CoSiNi | ICSD | 165256 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.000 | 0.473 | (0;011) | ✗ | 27/01/17 |
| FeCo2B | ICSD | 603579 | Pnma (62) | ✔ | 16 | 180 | 3 | 0.0 | 0.000 | 0.387 | (0;110) | ✗ | 05/01/17 |
| Fe2NiB | ICSD | 614129 | Pnma (62) | ✔ | 16 | 116 | 3 | 0.0 | 0.000 | 0.593 | (1;110) | ✗ | 05/01/17 |
| TiMnO3 | ICSD | 184650 | R3c (161) | ✗ | 10 | 90 | 3 | 0.0 | 0.000 | 0.795 | ? | ✗ | 06/10/16 |
| NaCuSO4F | ICSD | 262273 | C2/c (15) | ✔ | 16 | 114 | 3 | 0.0 | 0.000 | 0.143 | (1;101) | ✗ | 27/01/17 |
| MnCuP | ICSD | 72411 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.000 | 0.293 | (1;011) | ✗ | 27/01/17 |
| Mn3GeC | ICSD | 25775 | I4/mcm (140) | ✔ | 10 | 106 | 3 | 0.0 | 0.000 | 0.840 | (0;000) | ✗ | 27/01/17 |
| RbBi2 | ICSD | 150969 | Fd-3m (227) | ✔ | 6 | 78 | 3 | 0.0 | 0.000 | 0.801 | (0;000) | ✗ | 02/02/17 |
| FeSbPt | ICSD | 103606 | P2_13 (198) | ✗ | 12 | 92 | 3 | 0.0 | 0.000 | 0.320 | ? | ✗ | 06/10/16 |
| K3LiIrO4 | ICSD | 75045 | C2/c (15) | ✔ | 18 | 142 | 1 | 0.0 | 0.000 | 0.332 | (1;100) | ✗ | 02/02/17 |
| Fe2O2F5 | COD | 9015576 | Imma (74) | ✔ | 18 | 126 | 3 | 0.0 | 0.000 | 0.452 | (1;001) | ✗ | 02/02/17 |
| Re2BiO6 | ICSD | 181425 | C2/c (15) | ✔ | 18 | 162 | 3 | 0.0 | 0.000 | 0.476 | (1;100) | ✗ | 02/02/17 |
| Zr5CoSb3 | ICSD | 624928 | P6_3/mcm (193) | ✔ | 18 | 104 | 3 | 0.0 | 0.000 | 0.724 | (1;000) | ✗ | 02/02/17 |
| MnNi(BiO3)2 | ICSD | 153857 | P2_1/c (14) | ✔ | 20 | 182 | 3 | 0.0 | 0.000 | 0.877 | (0;000) | ✗ | 02/02/17 |
| YGePd2 | ICSD | 637566 | Pnma (62) | ✔ | 16 | 204 | 3 | 0.0 | 0.000 | 0.393 | (0;110) | ✗ | 02/02/17 |
| VCdO3 | COD | 1528346 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.000 | 0.658 | (0;110) | ✗ | 02/02/17 |
| K2Hg7 | ICSD | 107482 | P-3m1 (164) | ✔ | 9 | 102 | 3 | 0.0 | 0.000 | 0.665 | (0;001) | ✗ | 02/02/17 |
| Sc4Ge6Ru7 | ICSD | 637747 | Im-3m (229) | ✔ | 17 | 180 | 3 | 0.0 | 0.000 | 0.556 | (1;000) | ✗ | 02/02/17 |
| Y12Ni6Pb | ICSD | 54614 | Im3 (204) | ✔ | 19 | 206 | 3 | 0.0 | 0.000 | 0.506 | (1;000) | ✗ | 02/02/17 |
| YZn3 | COD | 2106397 | Pnma (62) | ✔ | 16 | 188 | 3 | 0.0 | 0.000 | 0.763 | (1;011) | ✗ | 02/02/17 |
| V2Cu3Sb4 | ICSD | 236572 | P6_3/mmc (194) | ✔ | 18 | 158 | 3 | 0.0 | 0.000 | 0.941 | (1;000) | ✗ | 02/02/17 |
| Nb5Ge3 | ICSD | 637206 | I4/mcm (140) | ✔ | 16 | 154 | 3 | 0.0 | 0.000 | 0.434 | (0;000) | ✗ | 02/02/17 |
| K2HgS4 | ICSD | 20757 | C2/c (15) | ✔ | 14 | 108 | 1 | 0.0 | 0.000 | 0.573 | (0;000) | ✗ | 02/02/17 |
| NaCoF3 | ICSD | 4404 | Pnma (62) | ✔ | 20 | 188 | 3 | 0.0 | 0.000 | 0.497 | (0;110) | ✗ | 02/02/17 |
| MgCu2TeO12 | COD | 9004452 | P-31m (162) | ✔ | 16 | 110 | 2 | 0.0 | 0.000 | 0.600 | (0;000) | ✗ | 02/02/17 |
| Mn(CrS2)2 | COD | 9012044 | Fd-3m (227) | ✔ | 14 | 134 | 3 | 0.0 | 0.000 | 0.808 | (0;000) | ✗ | 02/02/17 |
| K2Mn2O3 | ICSD | 61038 | P2_1/c (14) | ✔ | 14 | 132 | 3 | 0.0 | 0.000 | 0.388 | (1;101) | ✗ | 02/02/17 |
| Ta3Co5B2 | ICSD | 613327 | P4/mbm (127) | ✔ | 20 | 260 | 3 | 0.0 | 0.000 | 0.983 | (1;001) | ✗ | 02/02/17 |
| Na2MnCl4 | COD | 2106200 | Pbam (55) | ✔ | 14 | 122 | 1 | 0.0 | 0.000 | 0.664 | (0;000) | ✗ | 02/02/17 |
| Fe3C | ICSD | 42542 | P6_322 (182) | ✗ | 8 | 56 | 3 | 0.0 | 0.000 | 0.433 | ? | ✗ | 15/02/17 |
| Ba3CrO5 | ICSD | 73893 | I4/mcm (140) | ✔ | 18 | 148 | 1 | 0.0 | 0.000 | 0.531 | (1;000) | ✗ | 02/02/17 |
| KF5 | COD | 4335158 | I4_1/a (88) | ✔ | 12 | 88 | 1 | 0.0 | 0.000 | 0.199 | (1;111) | ✗ | 02/02/17 |
| Zr5Pb3S | ICSD | 604197 | P6_3/mcm (193) | ✔ | 18 | 136 | 3 | 0.0 | 0.000 | 0.224 | (0;000) | ✗ | 02/02/17 |
| KMnCl3 | ICSD | 32711 | Pnma (62) | ✔ | 20 | 180 | 1 | 0.0 | 0.000 | 0.373 | (0;011) | ✗ | 02/02/17 |
| YSiNi | ICSD | 79598 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.000 | 0.811 | (0;011) | ✗ | 02/02/17 |
| MgNi3B2 | ICSD | 156018 | P6_422 (181) | ✗ | 18 | 138 | 3 | 0.0 | 0.000 | 0.428 | ? | ✗ | 15/02/17 |
| Cs(WO3)2 | ICSD | 72634 | Fd-3m (227) | ✔ | 18 | 146 | 3 | 0.0 | 0.000 | 0.581 | (0;000) | ✗ | 02/02/17 |
| LiCaSi2 | ICSD | 25327 | Pnma (62) | ✔ | 16 | 84 | 1 | 0.0 | 0.000 | 0.766 | (0;011) | ✗ | 02/02/17 |
| Hf3In4 | ICSD | 638568 | P4/mbm (127) | ✔ | 14 | 176 | 3 | 0.0 | 0.000 | 0.432 | (1;000) | ✗ | 02/02/17 |
| Y2Zn17 | COD | 1522899 | R-3m (166) | ✔ | 19 | 226 | 3 | 0.0 | 0.000 | 0.513 | (1;000) | ✗ | 02/02/17 |
| K2CuF4 | ICSD | 174116 | Cmce (64) | ✔ | 14 | 114 | 2 | 0.0 | 0.000 | 0.932 | (0;000) | ✗ | 02/02/17 |
| YMoC2 | ICSD | 618370 | Pnma (62) | ✔ | 16 | 132 | 3 | 0.0 | 0.000 | 0.492 | (0;011) | ✗ | 02/02/17 |
| Zr5SiSn3 | ICSD | 656294 | P6_3/mcm (193) | ✔ | 18 | 132 | 3 | 0.0 | 0.000 | 0.562 | (0;000) | ✗ | 02/02/17 |
| Sr3Ag2 | COD | 1509721 | R-3 (148) | ✔ | 15 | 156 | 1 | 0.0 | 0.000 | 0.679 | (1;000) | ✗ | 30/01/17 |
| FeBiO3 | ICSD | 162895 | Pnma (62) | ✔ | 20 | 164 | 3 | 0.0 | 0.000 | 0.630 | (0;110) | ✗ | 02/02/17 |
| Cr2CuSe4 | ICSD | 625804 | Fd-3m (227) | ✔ | 14 | 126 | 3 | 0.0 | 0.000 | 0.543 | (0;000) | ✗ | 02/02/17 |
| Zr2Al3 | ICSD | 58232 | Fdd2 (43) | ✗ | 10 | 34 | 3 | 0.0 | 0.000 | 0.819 | ? | ✗ | 15/02/17 |
| Mn(BiSe2)2 | ICSD | 603311 | C2/m (12) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.138 | (0;110) | ✗ | 02/02/17 |
| Zr5Al4 | ICSD | 191012 | P6_3/mcm (193) | ✔ | 18 | 64 | 3 | 0.0 | 0.000 | 0.685 | (1;000) | ✗ | 30/01/17 |
| Zr5Al3 | ICSD | 58236 | I4/mcm (140) | ✔ | 16 | 58 | 3 | 0.0 | 0.000 | 0.691 | (1;000) | ✗ | 30/01/17 |
| Cs2CoSe2 | ICSD | 67392 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.000 | 0.185 | (0;000) | ✗ | 02/02/17 |
| CsScCl3 | COD | 4343633 | P6_3/mmc (194) | ✔ | 10 | 82 | 1 | 0.0 | 0.000 | 0.596 | (0;000) | ✗ | 02/02/17 |
| Y2Al | ICSD | 58211 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.000 | 0.573 | (0;011) | ✗ | 30/01/17 |
| Fe3Ge | COD | 1001144 | P6_3/mmc (194) | ✔ | 8 | 56 | 3 | 0.0 | 0.000 | 0.549 | (1;000) | ✗ | 27/01/17 |
| Co3S4 | COD | 1011056 | Fd-3m (227) | ✔ | 14 | 150 | 3 | 0.0 | 0.000 | 0.360 | (0;000) | ✗ | 02/02/17 |
| Y3Rh | ICSD | 650529 | Pnma (62) | ✔ | 16 | 200 | 3 | 0.0 | 0.000 | 0.353 | (0;000) | ✗ | 02/02/17 |
| Ca2Cu | ICSD | 108865 | Pnma (62) | ✔ | 12 | 124 | 1 | 0.0 | 0.000 | 0.526 | (1;011) | ✗ | 02/02/17 |
| Re5Si3 | ICSD | 650114 | I4/mcm (140) | ✔ | 16 | 174 | 3 | 0.0 | 0.000 | 0.864 | (1;111) | ✗ | 02/02/17 |
| Na3TiCl6 | ICSD | 411050 | P2_1/c (14) | ✔ | 20 | 162 | 1 | 0.0 | 0.000 | 0.724 | (0;000) | ✗ | 02/02/17 |
| Ca5Ir | ICSD | 156887 | Pnma (62) | ✔ | 24 | 268 | 1 | 0.0 | 0.000 | 0.625 | (1;110) | ✗ | 04/08/17 |
| Sc3P2 | ICSD | 41679 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.000 | 0.772 | (0;011) | ✗ | 29/03/17 |
| W3O8 | COD | 2101049 | C222 (21) | ✗ | 11 | 132 | 3 | 0.0 | 0.000 | 0.791 | ? | ✗ | 11/04/17 |
| Mn5Ge2 | ICSD | 40462 | Ibam (72) | ✔ | 14 | 166 | 3 | 0.0 | 0.000 | 0.631 | (0;100) | ✗ | 22/03/17 |
| ScCrO3 | ICSD | 85141 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.000 | 0.480 | (0;110) | ✗ | 22/03/17 |
| MnTlI3 | ICSD | 26421 | Pnma (62) | ✔ | 20 | 196 | 2 | 0.0 | 0.000 | 0.258 | (0;011) | ✗ | 29/03/17 |
| CrGe | ICSD | 626099 | P2_13 (198) | ✗ | 8 | 72 | 3 | 0.0 | 0.000 | 0.680 | ? | ✗ | 15/02/17 |
| RbPbIO6 | ICSD | 73615 | P6_322 (182) | ✗ | 18 | 132 | 2 | 0.0 | 0.000 | 0.244 | (1;000) | ✔ | 11/04/17 |
| FeSeBr7 | ICSD | 39528 | Pc (7) | ✗ | 18 | 126 | 1 | 0.0 | 0.000 | 0.345 | (0;100) | ✔ | 21/03/17 |
| Mg3Pd | COD | 8102899 | P6_3cm (185) | ✗ | 24 | 288 | 3 | 0.0 | 0.000 | 0.732 | ? | ✗ | 04/08/17 |
| KNi(PO3)3 | ICSD | 91527 | R3 (146) | ✗ | 14 | 88 | 3 | 0.0 | 0.000 | 0.653 | ? | ✗ | 29/03/17 |
| HfGa | COD | 1522450 | Pbcm (57) | ✔ | 24 | 300 | 3 | 0.0 | 0.000 | 0.699 | (1;000) | ✗ | 04/08/17 |
| Mn3(CuBi)4 | ICSD | 616588 | Fm-3m (225) | ✔ | 22 | 298 | 3 | 0.0 | 0.000 | 0.591 | (1;000) | ✗ | 08/08/17 |
| NiP3 | COD | 1526484 | Im3 (204) | ✔ | 16 | 100 | 3 | 0.0 | 0.000 | 0.714 | (1;111) | ✗ | 29/03/17 |
| Fe2CuS3 | ICSD | 159383 | Pnma (62) | ✔ | 24 | 180 | 3 | 0.0 | 0.000 | 0.594 | (1;110) | ✗ | 04/08/17 |
| Ba2MnS3 | ICSD | 603195 | Pnma (62) | ✔ | 24 | 212 | 1 | 0.0 | 0.000 | 0.930 | (1;011) | ✗ | 04/08/17 |
| CuSO4 | COD | 9009830 | Pnma (62) | ✔ | 24 | 164 | 3 | 0.0 | 0.000 | 0.272 | (0;101) | ✗ | 04/08/17 |