Plotting...
| ▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| V4SiSb2 | ICSD | 82564 | I4/mcm (140) | ✔ | 14 | 132 | 3 | 0.0 | 0.007 | 0.927 | (1;000) | ✗ | 02/02/17 |
| TaNi2Te3 | ICSD | 82605 | P2_1/m (11) | ✔ | 12 | 102 | 3 | 0.0 | 0.000 | 0.972 | (1;010) | ✗ | 02/02/17 |
| Cs2CaF4 | ICSD | 82616 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 6.3925 | 6.507 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CaV2O5 | ICSD | 82689 | Pmmn (59) | ✔ | 16 | 132 | 2 | 0.0 | 0.028 | 0.223 | (0;000) | ✗ | 02/02/17 |
| K3SeO4F | ICSD | 82750 | I4/mcm (140) | ✔ | 18 | 128 | 3 | 4.1863 | 4.311 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BaFeF4 | ICSD | 82765 | Ccm2_1 (36) | ✗ | 12 | 92 | 2 | 0.0565 | 0.274 | 0.000 | (0;000) | ✔ | 06/10/16 |
| AlN | ICSD | 82790 | P6_3mc (186) | ✗ | 4 | 16 | 3 | 4.4303 | 4.430 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ta3SeI7 | ICSD | 82791 | P6_3mc (186) | ✗ | 22 | 188 | 2 | 0.5635 | 0.581 | 0.000 | (0;000) | ✗ | 04/08/17 |
| NaNO2 | ICSD | 82857 | Im2m (44) | ✗ | 4 | 26 | 1 | 2.4951 | 2.675 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SrRuO3 | ICSD | 82977 | Pnma (62) | ✔ | 20 | 176 | 2 | 0.0 | 0.020 | 0.552 | (0;000) | ✗ | 02/02/17 |
| Nb3SnS6 | ICSD | 83038 | P6_322 (182) | ✗ | 20 | 178 | 3 | 0.0 | 0.000 | 0.986 | ? | ✗ | 29/03/17 |
| Ca2PdWO6 | ICSD | 83258 | Fm-3m (225) | ✔ | 10 | 88 | 3 | 0.0 | 0.000 | 0.719 | (0;000) | ✗ | 27/01/17 |
| Ca2PdWO6 | ICSD | 83259 | Pmm2 (25) | ✗ | 20 | 176 | 3 | 0.0 | 0.000 | 1.000 | ? | ✗ | 21/03/17 |
| C3N4 | ICSD | 83264 | P-43m (215) | ✗ | 7 | 32 | 3 | 2.5786 | 2.579 | 0.000 | (0;000) | ✗ | 06/10/16 |
| RbTe | ICSD | 83350 | Pbam (55) | ✔ | 8 | 60 | 1 | 0.795 | 0.875 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CsTe | ICSD | 83351 | Pbam (55) | ✔ | 8 | 60 | 1 | 0.9969 | 1.077 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CaP | ICSD | 83352 | P-62m (189) | ✗ | 12 | 90 | 1 | 0.2772 | 1.127 | 0.000 | (0;000) | ✔ | 22/03/17 |
| Ta2CuO6 | ICSD | 83367 | P4_2/mnm (136) | ✔ | 18 | 146 | 3 | 0.0 | 0.000 | 0.746 | (0;000) | ✗ | 02/02/17 |
| AlBr3 | ICSD | 83432 | P2_1/c (14) | ✔ | 16 | 96 | 1 | 4.1378 | 4.138 | 0.000 | (0;000) | ✗ | 30/01/17 |
| CsAlBr4 | ICSD | 83435 | Pnma (62) | ✔ | 24 | 160 | 1 | 4.4615 | 4.462 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ca2FeSbO6 | ICSD | 83473 | P2_1/c (14) | ✔ | 20 | 138 | 3 | 0.0 | 0.000 | 0.686 | (0;101) | ✗ | 02/02/17 |
| Y(CuO2)2 | ICSD | 83493 | C2/c (15) | ✔ | 14 | 114 | 3 | 0.0 | 0.000 | 0.368 | (1;101) | ✗ | 27/01/17 |
| Al2CdS4 | ICSD | 83526 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.885 | 2.993 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Al2CdSe4 | ICSD | 83527 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.1509 | 2.151 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaCO3 | ICSD | 83607 | C2 (5) | ✗ | 15 | 96 | 1 | 4.5726 | 4.806 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Sr2GaCuSO3 | ICSD | 83630 | P4/nmm (129) | ✔ | 16 | 136 | 1 | 0.9682 | 0.968 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ga2HgSe4 | ICSD | 83712 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.0363 | 1.036 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Bi(TeBr2)2 | ICSD | 83806 | P-1 (2) | ✔ | 14 | 110 | 3 | 1.0464 | 1.099 | 0.000 | (0;000) | ✗ | 02/02/17 |
| HfO2 | ICSD | 83863 | Pnma (62) | ✔ | 12 | 96 | 3 | 3.3241 | 3.324 | 0.000 | (0;000) | ✗ | 27/01/17 |
| RuCl2O | ICSD | 83883 | Immm (71) | ✔ | 4 | 36 | 2 | 0.0 | 0.038 | 0.984 | (0;000) | ✗ | 27/01/17 |
| OsCl2O | ICSD | 83884 | Immm (71) | ✔ | 4 | 36 | 2 | 0.0 | 0.081 | 0.959 | (0;000) | ✗ | 27/01/17 |
| NbFeSb | ICSD | 83928 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.5254 | 1.135 | 0.000 | (0;000) | ✗ | 15/02/17 |
| NbSbRu | ICSD | 83929 | F-43m (216) | ✗ | 3 | 34 | 3 | 0.3146 | 1.279 | 0.000 | (0;000) | ✔ | 15/02/17 |
| Hf2Te | ICSD | 83965 | C2/m (12) | ✔ | 12 | 120 | 3 | 0.0 | 0.020 | 0.842 | (0;000) | ✗ | 02/02/17 |
| CsBr2F | ICSD | 84019 | P4/mmm (123) | ✔ | 4 | 30 | 1 | 1.4039 | 1.404 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Se2NCl3 | ICSD | 84030 | P2_1/c (14) | ✔ | 24 | 152 | 1 | 0.7486 | 0.749 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Li6Br3N | ICSD | 84092 | P2_1/c (14) | ✔ | 20 | 88 | 1 | 2.3159 | 2.316 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Zr2CuGe4 | ICSD | 84200 | Cmcm (63) | ✔ | 14 | 70 | 3 | 0.0 | 0.000 | 0.774 | (0;110) | ✗ | 02/02/17 |
| ScFeSi | ICSD | 84203 | Pnma (62) | ✔ | 12 | 92 | 3 | 0.0 | 0.001 | 0.734 | (0;011) | ✗ | 27/01/17 |
| Sc3Fe2Si3 | ICSD | 84204 | Cmcm (63) | ✔ | 16 | 122 | 3 | 0.0 | 0.000 | 0.904 | (1;110) | ✗ | 02/02/17 |
| Y2Si5Ni3 | ICSD | 84206 | Ibam (72) | ✔ | 20 | 144 | 3 | 0.0 | 0.017 | 0.369 | (0;111) | ✗ | 02/02/17 |
| Re3Ge7 | ICSD | 84208 | Cmcm (63) | ✔ | 20 | 146 | 3 | 0.0 | 0.000 | 0.856 | (1;000) | ✗ | 02/02/17 |
| RbCuCl3 | ICSD | 84212 | P6_3/mmc (194) | ✔ | 10 | 82 | 1 | 0.0 | 0.000 | 0.655 | (0;000) | ✗ | 02/02/17 |
| CuI | ICSD | 84217 | P3m1 (156) | ✗ | 4 | 36 | 2 | 1.3365 | 1.337 | 0.000 | (0;000) | ✗ | 06/10/16 |
| LiTaO3 | ICSD | 84226 | R3c (161) | ✗ | 10 | 68 | 3 | 3.4507 | 3.498 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K2NbAgS4 | ICSD | 84292 | Fddd (70) | ✔ | 16 | 132 | 1 | 2.1824 | 2.203 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Cs2NbAgS4 | ICSD | 84293 | Fddd (70) | ✔ | 16 | 132 | 1 | 2.2864 | 2.392 | 0.000 | (0;000) | ✗ | 16/03/17 |
| K2TaAgS4 | ICSD | 84294 | Fddd (70) | ✔ | 16 | 132 | 1 | 2.5212 | 2.523 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Rb2TaAgS4 | ICSD | 84295 | Fddd (70) | ✔ | 16 | 132 | 1 | 2.5821 | 2.591 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Cs2TaAgS4 | ICSD | 84296 | Fddd (70) | ✔ | 16 | 132 | 1 | 2.5887 | 2.703 | 0.000 | (0;000) | ✗ | 16/03/17 |
| Rb2VCuS4 | ICSD | 84302 | Fddd (70) | ✔ | 16 | 132 | 1 | 1.2635 | 1.533 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K2VCuSe4 | ICSD | 84303 | Fddd (70) | ✔ | 16 | 132 | 1 | 0.9604 | 1.170 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb2NbCuS4 | ICSD | 84304 | Fddd (70) | ✔ | 16 | 132 | 1 | 2.0266 | 2.249 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb2NbCuSe4 | ICSD | 84305 | Fddd (70) | ✔ | 16 | 132 | 1 | 1.6556 | 1.888 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cs2NbCuSe4 | ICSD | 84306 | Fddd (70) | ✔ | 16 | 132 | 1 | 1.6663 | 2.025 | 0.000 | (0;000) | ✗ | 22/03/17 |
| KTe2F9 | ICSD | 84364 | P-1 (2) | ✔ | 24 | 168 | 1 | 4.6391 | 4.676 | 0.000 | (0;000) | ✗ | 04/08/17 |
| AgH4WS4N | ICSD | 84370 | I-4 (82) | ✗ | 11 | 72 | 1 | 1.6977 | 1.953 | 0.000 | (0;000) | ✗ | 11/04/17 |
| LiTaO3 | ICSD | 84579 | R3c (161) | ✗ | 10 | 68 | 3 | 3.7989 | 3.825 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MoCl5 | ICSD | 84620 | P-1 (2) | ✔ | 12 | 98 | 1 | 0.0 | 0.021 | 0.413 | (1;110) | ✗ | 06/10/16 |
| CaBiClO2 | ICSD | 84635 | P2_1/m (11) | ✔ | 10 | 88 | 1 | 3.3755 | 3.652 | 0.000 | (0;000) | ✗ | 05/01/17 |
| SrBiClO2 | ICSD | 84636 | Cmcm (63) | ✔ | 10 | 88 | 1 | 3.1208 | 3.196 | 0.000 | (0;000) | ✗ | 05/01/17 |
| CrWN2 | ICSD | 84639 | R3m (160) | ✗ | 4 | 38 | 3 | 0.0 | 0.022 | 1.000 | (1;110) | ✔ | 05/12/16 |
| Li4NCl | ICSD | 84649 | R-3m (166) | ✔ | 6 | 24 | 1 | 1.8222 | 1.875 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BaRuO3 | ICSD | 84652 | P6_3/mmc (194) | ✔ | 20 | 176 | 3 | 0.0 | 0.006 | 0.695 | (0;000) | ✗ | 02/02/17 |
| SrZrSe3 | ICSD | 84723 | Pnma (62) | ✔ | 20 | 128 | 2 | 0.1594 | 0.178 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sr2ZnCu2(SO)2 | ICSD | 84735 | I4/mmm (139) | ✔ | 9 | 78 | 3 | 0.6692 | 1.036 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Li5NCl2 | ICSD | 84763 | R-3m (166) | ✔ | 8 | 34 | 1 | 1.7049 | 1.706 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Cu(SbO3)2 | ICSD | 84789 | P4_2/mnm (136) | ✔ | 18 | 114 | 3 | 0.0 | 0.000 | 0.877 | (0;000) | ✗ | 27/01/17 |
| Ca3ReO6 | ICSD | 84791 | P2_1/c (14) | ✔ | 20 | 162 | 1 | 0.0 | 0.000 | 0.860 | (0;101) | ✗ | 02/02/17 |
| Zr2CoP | ICSD | 84825 | P2_1/m (11) | ✔ | 8 | 60 | 3 | 0.0 | 0.003 | 0.620 | (1;000) | ✗ | 27/01/17 |
| Zr2NiP | ICSD | 84826 | P2_1/m (11) | ✔ | 8 | 46 | 3 | 0.0 | 0.000 | 0.865 | (0;010) | ✗ | 27/01/17 |
| Hf2CoP | ICSD | 84827 | P2_1/m (11) | ✔ | 8 | 92 | 3 | 0.0 | 0.014 | 0.572 | (0;000) | ✗ | 27/01/17 |
| BaCo2P2H2O9 | ICSD | 84830 | C2 (5) | ✗ | 16 | 110 | 2 | 0.0 | 0.007 | 0.518 | ? | ✗ | 15/02/17 |
| CrSbSe3 | ICSD | 84866 | Pnma (62) | ✔ | 20 | 148 | 3 | 0.0 | 0.000 | 0.503 | (0;011) | ✗ | 02/02/17 |
| CaCuO2 | ICSD | 84868 | P2_1 (4) | ✗ | 16 | 132 | 3 | 0.0 | 0.029 | 0.279 | ? | ✗ | 04/08/17 |
| Y4C5 | ICSD | 84869 | Pbam (55) | ✔ | 18 | 128 | 3 | 0.0 | 0.005 | 0.807 | (0;100) | ✗ | 02/02/17 |
| Si3P2Pt | ICSD | 84944 | P1 (1) | ✗ | 12 | 64 | 3 | 0.6365 | 1.195 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Sr3Fe2Cu2S2O5 | ICSD | 84961 | I4/mmm (139) | ✔ | 14 | 110 | 1 | 0.0 | 0.001 | 0.956 | (0;000) | ✗ | 22/03/17 |
| Sr2CrCuSO3 | ICSD | 84962 | P4/nmm (129) | ✔ | 16 | 138 | 1 | 0.0 | 0.000 | 0.947 | (1;001) | ✗ | 02/02/17 |
| Sr2FeCuSO3 | ICSD | 84963 | P4/nmm (129) | ✔ | 16 | 126 | 1 | 0.0 | 0.000 | 0.752 | (1;001) | ✗ | 02/02/17 |
| CsTeSe3 | ICSD | 84993 | P2_1/c (14) | ✔ | 20 | 132 | 3 | 0.9985 | 1.018 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ZrGeSb | ICSD | 85000 | P4/nmm (129) | ✔ | 6 | 26 | 3 | 0.0 | 0.000 | 0.893 | (0;001) | ✗ | 27/01/17 |
| RbGeI3 | ICSD | 85041 | P2_12_12_1 (19) | ✗ | 20 | 136 | 2 | 1.9977 | 2.094 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Na4WO5 | ICSD | 85063 | P-1 (2) | ✔ | 20 | 188 | 2 | 0.0 | 0.022 | 0.061 | (0;000) | ✗ | 11/04/17 |
| Ag2TeS3 | ICSD | 85135 | Cc (9) | ✗ | 12 | 92 | 3 | 1.0746 | 1.075 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cu2GeS3 | ICSD | 85138 | Cc (9) | ✗ | 12 | 88 | 3 | 0.3087 | 0.312 | 0.000 | (0;000) | ✔ | 05/12/16 |
| ScCrO3 | ICSD | 85141 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.000 | 0.480 | (0;110) | ✗ | 22/03/17 |
| YNiBC | ICSD | 85283 | P4/nmm (129) | ✔ | 8 | 56 | 3 | 0.0 | 0.017 | 0.299 | (1;001) | ✗ | 27/01/17 |
| SbSI | ICSD | 85298 | P2_12_12_1 (19) | ✗ | 12 | 72 | 3 | 0.9316 | 1.107 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbSI | ICSD | 85299 | P2_12_12_1 (19) | ✗ | 12 | 72 | 3 | 0.9264 | 1.109 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbSI | ICSD | 85300 | P2_12_12_1 (19) | ✗ | 12 | 72 | 3 | 0.9346 | 1.110 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Sb2S3 | ICSD | 85302 | Pmn2_1 (31) | ✗ | 20 | 112 | 2 | 0.0 | 0.034 | 0.132 | ? | ✗ | 04/08/17 |
| Sr(NiP)2 | ICSD | 85406 | Immm (71) | ✔ | 15 | 120 | 2 | 0.0 | 0.007 | 0.951 | (1;111) | ✗ | 02/02/17 |
| Ba(NiP)2 | ICSD | 85408 | I4/mmm (139) | ✔ | 5 | 40 | 2 | 0.0 | 0.013 | 0.833 | (1;111) | ✗ | 05/01/17 |
| SeF4 | ICSD | 85451 | P2_12_12_1 (19) | ✗ | 20 | 136 | 1 | 4.7305 | 4.799 | 0.000 | (0;000) | ✗ | 22/03/17 |
| TeF4 | ICSD | 85452 | P2_12_12_1 (19) | ✗ | 20 | 136 | 2 | 4.2126 | 4.283 | 0.000 | (0;000) | ✗ | 22/03/17 |
| KNO3 | ICSD | 85491 | Pnma (62) | ✔ | 20 | 128 | 1 | 3.5677 | 3.595 | 0.000 | (0;000) | ✗ | 02/02/17 |
| RbFeF4 | ICSD | 85499 | P4/mbm (127) | ✔ | 12 | 90 | 2 | 0.0 | 0.000 | 0.764 | (0;000) | ✗ | 27/01/17 |
| RbFeF4 | ICSD | 85500 | P2_12_12 (18) | ✗ | 24 | 180 | 1 | 0.0 | 0.004 | 0.465 | ? | ✗ | 04/08/17 |
| K2Ca(NO2)4 | ICSD | 85505 | C2/m (12) | ✔ | 15 | 96 | 1 | 0.0 | 0.009 | 0.648 | (1;001) | ✗ | 02/02/17 |