Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| In2HgSe4 | ICSD | 25649 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.5886 | 0.589 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MgCl2 | ICSD | 51247 | P-1 (2) | ✔ | 6 | 48 | 3 | 2.4906 | 2.491 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MgCl2 | ICSD | 51244 | Pmmb (51) | ✔ | 6 | 48 | 2 | 0.0 | 0.007 | 0.196 | (0;000) | ✗ | 06/10/16 |
| MgP4 | ICSD | 113 | P2_1/c (14) | ✔ | 10 | 60 | 1 | 0.6744 | 0.674 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CrCl2 | ICSD | 15467 | Pmnn (58) | ✔ | 6 | 56 | 1 | 0.0 | 0.015 | 0.396 | (0;000) | ✗ | 06/10/16 |
| TlCl | ICSD | 109143 | Cmcm (63) | ✔ | 4 | 40 | 1 | 2.1142 | 2.114 | 0.000 | (0;000) | ✗ | 27/01/17 |
| MgO | ICSD | 166273 | P-6m2 (187) | ✗ | 2 | 16 | 3 | 2.2858 | 2.517 | 0.000 | (0;000) | ✗ | 06/10/16 |
| GeC | ICSD | 182363 | F-43m (216) | ✗ | 2 | 8 | 3 | 1.5913 | 3.553 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MgO | ICSD | 161842 | P6_3mc (186) | ✗ | 4 | 32 | 3 | 3.6457 | 3.646 | 0.000 | (0;000) | ✗ | 06/10/16 |
| InCl | ICSD | 2430 | Cmcm (63) | ✔ | 4 | 40 | 1 | 1.443 | 1.529 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Rb4CO4 | ICSD | 245438 | Cm (8) | ✗ | 9 | 64 | 3 | 1.4937 | 1.585 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cd(GaSe2)2 | ICSD | 163949 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.251 | 1.251 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AuCN | ICSD | 165173 | P6mm (183) | ✗ | 3 | 20 | 3 | 0.0 | 0.997 | 0.042 | (0;000) | ✔ | 06/10/16 |
| CF4 | ICSD | 2848 | C2/c (15) | ✔ | 10 | 64 | 1 | 9.4116 | 9.472 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Zr3(Cu2Ge)2 | ICSD | 53286 | P-62m (189) | ✗ | 9 | 64 | 3 | 0.0 | 0.010 | 0.223 | (0;000) | ✔ | 06/10/16 |
| TlIO3 | ICSD | 62106 | R3m (160) | ✗ | 5 | 38 | 1 | 2.5705 | 2.612 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KNbO3 | ICSD | 190923 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4036 | 3.267 | 0.000 | (0;000) | ✗ | 06/10/16 |
| VCu3Se4 | ICSD | 629147 | P-43m (215) | ✗ | 8 | 70 | 3 | 0.814 | 1.200 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Pb4SeBr6 | ICSD | 21039 | Imm2 (44) | ✗ | 11 | 104 | 3 | 0.9075 | 0.993 | 0.000 | (0;000) | ✗ | 06/10/16 |
| HfSO | ICSD | 23327 | P2_13 (198) | ✗ | 12 | 96 | 3 | 2.7591 | 3.483 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NbBr2O | ICSD | 416669 | C2 (5) | ✗ | 8 | 66 | 2 | 0.7552 | 0.860 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdTe | ICSD | 246692 | Cmcm (63) | ✔ | 4 | 36 | 3 | 0.0 | 0.131 | 0.244 | (0;000) | ✗ | 27/01/17 |
| VCu3Se4 | ICSD | 629148 | P-43m (215) | ✗ | 8 | 70 | 3 | 0.7827 | 1.171 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbSI | ICSD | 41589 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.3524 | 1.490 | 0.000 | (0;000) | ✗ | 06/10/16 |
| RbIO3 | ICSD | 2825 | R3m (160) | ✗ | 5 | 34 | 1 | 2.7038 | 2.708 | 0.000 | (0;000) | ✗ | 06/10/16 |
| VCu3Se4 | ICSD | 601475 | P-43m (215) | ✗ | 8 | 70 | 3 | 0.813 | 1.198 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbSI | ICSD | 26924 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.4207 | 1.565 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TaCu3Te4 | ICSD | 629308 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.0132 | 1.582 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KBrO3 | ICSD | 47173 | R3m (160) | ✗ | 5 | 34 | 1 | 3.909 | 3.909 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SrHgO2 | ICSD | 69739 | P3_2 (145) | ✗ | 12 | 102 | 2 | 2.4955 | 2.570 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbSI | ICSD | 28263 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.4604 | 1.638 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbIrS | ICSD | 41400 | P2_13 (198) | ✗ | 12 | 80 | 3 | 1.5396 | 1.688 | 0.000 | (0;000) | ✗ | 06/10/16 |
| GaAs | ICSD | 190423 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.685 | 0.685 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaTe | ICSD | 41959 | Pnma (62) | ✔ | 8 | 64 | 3 | 0.0 | 0.022 | 0.119 | (0;000) | ✗ | 27/01/17 |
| ZnCd3Se4 | ICSD | 188386 | P-43m (215) | ✗ | 8 | 72 | 3 | 0.425 | 0.425 | 0.000 | (0;000) | ✔ | 06/10/16 |
| Cd(GaSe2)2 | ICSD | 30908 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.445 | 1.445 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Li4CO4 | ICSD | 245393 | C2 (5) | ✗ | 9 | 40 | 2 | 4.5571 | 4.885 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AlRh | ICSD | 609214 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.047 | 0.337 | (0;000) | ✗ | 05/01/17 |
| In2HgTe4 | ICSD | 25652 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.3925 | 0.393 | 0.000 | (0;000) | ✔ | 06/10/16 |
| VCu3Se4 | ICSD | 409449 | P-43m (215) | ✗ | 8 | 70 | 3 | 0.8183 | 1.205 | 0.000 | (0;000) | ✗ | 06/10/16 |
| InBiS3 | ICSD | 290195 | P2_1 (4) | ✗ | 10 | 72 | 3 | 0.8716 | 1.031 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K2Se3 | ICSD | 1264 | Ccm2_1 (36) | ✗ | 10 | 72 | 1 | 0.7025 | 0.851 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Rb4CO4 | ICSD | 245439 | I222 (23) | ✗ | 9 | 64 | 3 | 2.2513 | 2.375 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Hf3(SiCu2)2 | ICSD | 53288 | P-62m (189) | ✗ | 9 | 88 | 3 | 0.0 | 0.019 | 0.311 | (0;000) | ✔ | 05/12/16 |
| BiTeI | ICSD | 74501 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.003 | 0.261 | (0;000) | ✔ | 06/10/16 |
| BiTeI | ICSD | 263109 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.1819 | 0.182 | 0.000 | (0;000) | ✔ | 06/10/16 |
| RuBr3 | ICSD | 28119 | Cm2m (38) | ✗ | 8 | 74 | 1 | 0.0 | 0.064 | 0.330 | (0;000) | ✔ | 06/10/16 |
| BiTeI | ICSD | 10500 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.255 | (0;000) | ✔ | 06/10/16 |
| CsN | ICSD | 29106 | Pm-3m (221) | ✔ | 2 | 14 | 1 | 0.0 | 0.000 | 0.697 | (0;000) | ✗ | 27/01/17 |
| Li5BiO5 | ICSD | 203031 | Cm (8) | ✗ | 11 | 50 | 2 | 1.5359 | 1.767 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BiPO4 | ICSD | 27469 | P2_1 (4) | ✗ | 12 | 68 | 3 | 2.0944 | 2.399 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdC | ICSD | 183178 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.000 | 0.842 | (0;000) | ✔ | 06/10/16 |
| KSb2 | ICSD | 80945 | C2/m (12) | ✔ | 6 | 38 | 1 | 0.1801 | 0.569 | 0.000 | (0;000) | ✔ | 02/02/17 |
| TaCu3Te4 | ICSD | 80282 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.0131 | 1.581 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KNbO3 | ICSD | 190922 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.1224 | 2.960 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cd2P3Br | ICSD | 100817 | Cc (9) | ✗ | 12 | 92 | 3 | 1.0294 | 1.383 | 0.000 | (0;000) | ✗ | 06/10/16 |
| HgIBr | ICSD | 109010 | Ccm2_1 (36) | ✗ | 6 | 52 | 2 | 1.3842 | 1.389 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KBrO3 | ICSD | 33663 | R3m (160) | ✗ | 5 | 34 | 1 | 3.1451 | 3.145 | 0.000 | (0;000) | ✗ | 06/10/16 |
| LiNbO3 | ICSD | 169695 | R3c (161) | ✗ | 10 | 68 | 3 | 3.429 | 3.550 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KBrO3 | ICSD | 74767 | R3m (160) | ✗ | 5 | 34 | 1 | 3.8919 | 3.892 | 0.000 | (0;000) | ✗ | 06/10/16 |
| RbBrO3 | ICSD | 74768 | R3m (160) | ✗ | 5 | 34 | 1 | 4.0343 | 4.035 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TlBrO3 | ICSD | 76966 | R3m (160) | ✗ | 5 | 38 | 1 | 2.7769 | 2.778 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbSBr | ICSD | 88587 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.6228 | 1.792 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ZnCd3S4 | ICSD | 169187 | P-43m (215) | ✗ | 8 | 72 | 3 | 1.364 | 1.364 | 0.000 | (0;000) | ✗ | 06/10/16 |
| LiNbO3 | ICSD | 169696 | R3c (161) | ✗ | 10 | 68 | 3 | 3.0848 | 3.185 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaGa | ICSD | 260641 | Ccmm (63) | ✔ | 4 | 46 | 1 | 0.0 | 0.000 | 0.830 | (0;000) | ✗ | 06/10/16 |
| TaCu3Se4 | ICSD | 156981 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.5486 | 1.963 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TaCu3Se4 | ICSD | 427174 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.5807 | 2.033 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaC2 | ICSD | 74665 | I4/mmm (139) | ✔ | 3 | 18 | 1 | 1.6401 | 2.615 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Li2S | ICSD | 91283 | P2_1nb (33) | ✗ | 12 | 48 | 1 | 2.808 | 3.650 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaC2 | ICSD | 66663 | P-1 (2) | ✔ | 6 | 36 | 1 | 2.4633 | 3.084 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Nb3SBr7 | ICSD | 81078 | P3m1 (156) | ✗ | 11 | 94 | 2 | 0.7653 | 0.766 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ta3SBr7 | ICSD | 51101 | Cm (8) | ✗ | 11 | 94 | 2 | 0.7877 | 0.789 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AgCN | ICSD | 85783 | R3m (160) | ✗ | 3 | 20 | 1 | 2.5177 | 3.110 | 0.000 | (0;000) | ✗ | 06/10/16 |
| RhBr3 | ICSD | 28245 | C2/m (12) | ✔ | 8 | 76 | 2 | 1.23 | 1.361 | 0.000 | (0;000) | ✗ | 02/02/17 |
| AuCN | ICSD | 165175 | P6mm (183) | ✗ | 3 | 20 | 3 | 0.9094 | 1.164 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AuCN | ICSD | 85782 | P6mm (183) | ✗ | 3 | 20 | 3 | 0.0 | 0.999 | 0.053 | (0;000) | ✔ | 06/10/16 |
| Rb4CO4 | ICSD | 245437 | R3 (146) | ✗ | 9 | 64 | 3 | 2.8509 | 2.870 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BaCO3 | ICSD | 158389 | R3m (160) | ✗ | 5 | 32 | 1 | 3.7206 | 3.786 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BaCO3 | ICSD | 158390 | R3m (160) | ✗ | 5 | 32 | 1 | 3.7237 | 3.789 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na2Cl | ICSD | 190546 | Cmmm (65) | ✔ | 6 | 50 | 3 | 0.0 | 0.508 | 0.159 | (0;000) | ✗ | 06/10/16 |
| CaCO3 | ICSD | 161820 | C222_1 (20) | ✗ | 10 | 64 | 3 | 5.1926 | 5.193 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaCO3 | ICSD | 180348 | R-3c (167) | ✔ | 10 | 64 | 2 | 5.0647 | 5.184 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaCO3 | ICSD | 180349 | R-3c (167) | ✔ | 10 | 64 | 2 | 5.1604 | 5.214 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdCN2 | ICSD | 95265 | R3m (160) | ✗ | 4 | 26 | 3 | 2.021 | 2.021 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CClF3 | ICSD | 49696 | Ccm2_1 (36) | ✗ | 10 | 64 | 1 | 6.6335 | 6.643 | 0.000 | (0;000) | ✗ | 06/10/16 |
| C(ClF)2 | ICSD | 33946 | F2dd (43) | ✗ | 10 | 64 | 1 | 5.5318 | 5.537 | 0.000 | (0;000) | ✗ | 06/10/16 |
| C(ClF)2 | ICSD | 33947 | F2dd (43) | ✗ | 10 | 64 | 1 | 5.63 | 5.635 | 0.000 | (0;000) | ✗ | 06/10/16 |
| C(ClF)2 | ICSD | 33948 | F2dd (43) | ✗ | 10 | 64 | 1 | 5.7375 | 5.742 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CIN | ICSD | 77911 | R3m (160) | ✗ | 3 | 16 | 1 | 3.8512 | 3.926 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KCN | ICSD | 173942 | Cc (9) | ✗ | 6 | 36 | 1 | 5.131 | 5.273 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KCN | ICSD | 27350 | Cm (8) | ✗ | 3 | 18 | 1 | 4.9473 | 5.716 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KCN | ICSD | 27351 | Cm (8) | ✗ | 3 | 18 | 1 | 4.6894 | 5.539 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KCN | ICSD | 27352 | Cm (8) | ✗ | 3 | 18 | 1 | 5.6021 | 6.193 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K4CO4 | ICSD | 245417 | P-43m (215) | ✗ | 9 | 64 | 3 | 2.878 | 2.878 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K4CO4 | ICSD | 245418 | R3m (160) | ✗ | 9 | 64 | 3 | 2.2834 | 2.355 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K4CO4 | ICSD | 245421 | Cm (8) | ✗ | 9 | 64 | 3 | 0.521 | 0.796 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K4CO4 | ICSD | 245422 | C2 (5) | ✗ | 9 | 64 | 2 | 2.3193 | 2.486 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K4CO4 | ICSD | 245423 | R3 (146) | ✗ | 9 | 64 | 3 | 3.2247 | 3.274 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ge2N2O | ICSD | 200849 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.2545 | 2.593 | 0.000 | (0;000) | ✗ | 06/10/16 |