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| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TiBr2 | ICSD | 26078 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.0 | 0.005 | 0.539 | (0;000) | ✗ | 27/01/17 |
| AlAgS2 | ICSD | 25356 | P3m1 (156) | ✗ | 4 | 26 | 3 | 1.7772 | 1.844 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ZnBr2 | COD | 9011540 | R-3m (166) | ✔ | 3 | 26 | 2 | 2.4418 | 2.445 | 0.000 | (0;000) | ✗ | 27/01/17 |
| YNiSb | COD | 1523479 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.3035 | 1.161 | 0.000 | (0;000) | ✔ | 15/02/17 |
| MoS2 | ICSD | 26622 | R-3m (166) | ✔ | 3 | 26 | 2 | 0.0 | 0.053 | 0.331 | (1;111) | ✗ | 27/01/17 |
| CdBr2 | COD | 9009124 | R-3m (166) | ✔ | 3 | 26 | 2 | 2.7703 | 2.910 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TiF2 | ICSD | 65410 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 0.0 | 0.000 | 0.347 | (0;000) | ✗ | 27/01/17 |
| FeN | COD | 1524693 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.679 | (0;000) | ✗ | 27/01/17 |
| KZnSb | ICSD | 44680 | P-6m2 (187) | ✗ | 3 | 26 | 2 | 0.2326 | 0.390 | 0.000 | (0;000) | ✔ | 06/10/16 |
| TiGePt | ICSD | 188965 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.7725 | 1.701 | 0.000 | (0;000) | ✗ | 15/02/17 |
| VFeSb | ICSD | 53539 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.3352 | 0.888 | 0.000 | (0;000) | ✔ | 15/02/17 |
| LaPt | ICSD | 641688 | Ccmm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.831 | (0;110) | ✗ | 06/10/16 |
| LaPd | ICSD | 641672 | Ccmm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.854 | (0;110) | ✗ | 06/10/16 |
| LaNi | ICSD | 641489 | Ccmm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.851 | (1;110) | ✗ | 06/10/16 |
| VFeSb | ICSD | 152794 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.0 | 0.312 | 0.218 | (0;000) | ✔ | 15/02/17 |
| Y2C | ICSD | 96329 | R-3m (166) | ✔ | 3 | 26 | 3 | 0.0 | 0.012 | 0.308 | (1;111) | ✗ | 27/01/17 |
| ZrCoSb | ICSD | 108317 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.0 | 0.276 | 0.162 | (0;000) | ✔ | 15/02/17 |
| ZrAl3 | COD | 2100751 | I4/mmm (139) | ✔ | 8 | 26 | 3 | 0.0 | 0.005 | 0.764 | (0;000) | ✗ | 05/01/17 |
| CrS2 | ICSD | 75420 | C2/m (12) | ✔ | 3 | 26 | 2 | 0.0 | 0.051 | 0.157 | (0;100) | ✔ | 04/10/16 |
| HgF2 | COD | 9009017 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 0.4966 | 0.497 | 0.000 | (0;000) | ✗ | 27/01/17 |
| MgCuSb | ICSD | 77364 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.0 | 0.000 | 0.243 | (1;000) | ✔ | 15/02/17 |
| ZrH | ICSD | 169451 | P4_2/mmc (131) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.564 | (0;011) | ✗ | 06/10/16 |
| TiH | ICSD | 168325 | P4_2/mmc (131) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.512 | (0;011) | ✗ | 06/10/16 |
| H2CN4 | COD | 2006099 | P1 (1) | ✗ | 7 | 26 | 1 | 4.8806 | 5.045 | 0.000 | (0;000) | ✗ | 15/02/17 |
| CuCSN | ICSD | 24372 | R3m (160) | ✗ | 4 | 26 | 3 | 2.1878 | 2.361 | 0.000 | (0;000) | ✗ | 15/02/17 |
| PbO2 | COD | 9005762 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 0.0 | 0.000 | 0.084 | (1;000) | ✗ | 27/01/17 |
| LiCuO2 | ICSD | 74978 | C2/m (12) | ✔ | 4 | 26 | 2 | 0.4034 | 0.819 | 0.000 | (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 |
| CdF2 | COD | 9009006 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 3.0777 | 3.498 | 0.000 | (0;000) | ✗ | 27/01/17 |
| OsN2 | ICSD | 290439 | P-6m2 (187) | ✗ | 3 | 26 | 3 | 0.0 | 0.000 | 0.655 | (0;100) | ✔ | 06/10/16 |
| Sc2C | ICSD | 280743 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.0 | 0.001 | 0.283 | (1;001) | ✗ | 27/01/17 |
| SnSe2 | ICSD | 43857 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.6943 | 1.066 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Zr2Sb | ICSD | 107691 | I4/mmm (139) | ✔ | 6 | 26 | 3 | 0.0 | 0.016 | 0.568 | (0;111) | ✗ | 27/01/17 |
| MoSe2 | ICSD | 16948 | R3m (160) | ✗ | 3 | 26 | 0 | 0.8542 | 1.333 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CrSe2 | ICSD | 626718 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.0 | 0.094 | 0.232 | (1;001) | ✗ | 27/01/17 |
| MoS2 | ICSD | 38401 | R3m (160) | ✗ | 3 | 26 | 2 | 0.8476 | 1.670 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Li2H2Pd | ICSD | 108534 | I4/mmm (139) | ✔ | 5 | 26 | 2 | 0.0 | 0.020 | 0.279 | (0;111) | ✗ | 27/01/17 |
| Li2AlRh | COD | 1523430 | F-43m (216) | ✗ | 4 | 26 | 3 | 0.0 | 0.073 | 0.688 | ? | ✗ | 15/02/17 |
| BPt | COD | 9008910 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.822 | (0;000) | ✗ | 27/01/17 |
| NiB | COD | 9008947 | Cmcm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.399 | (0;110) | ✗ | 27/01/17 |
| BPt | COD | 1511304 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.556 | (1;000) | ✗ | 27/01/17 |
| NaC | ICSD | 95835 | Immm (71) | ✔ | 4 | 26 | 1 | 3.6931 | 3.727 | 0.000 | (0;000) | ✗ | 27/01/17 |
| MnAu | ICSD | 109348 | Pm-3m (221) | ✔ | 2 | 26 | 3 | 0.0 | 0.000 | 0.798 | (1;111) | ✗ | 05/01/17 |
| KNO2 | ICSD | 26764 | Cm (8) | ✗ | 4 | 26 | 1 | 2.3753 | 2.619 | 0.000 | (0;000) | ✗ | 06/10/16 |
| LiYSe2 | ICSD | 44963 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.0914 | 2.359 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiYS2 | ICSD | 44957 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.6757 | 2.755 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiScS2 | ICSD | 642305 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.5243 | 2.409 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ba2HN | COD | 4030485 | R-3m (166) | ✔ | 4 | 26 | 1 | 1.046 | 1.336 | 0.000 | (0;000) | ✗ | 05/01/17 |
| KNO2 | ICSD | 36202 | Cm (8) | ✗ | 4 | 26 | 1 | 0.0 | 0.017 | 0.075 | (1;100) | ✔ | 06/10/16 |
| MgAgSb | ICSD | 187149 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.0 | 0.000 | 0.283 | (1;000) | ✔ | 15/02/17 |
| NaNO2 | ICSD | 82857 | Im2m (44) | ✗ | 4 | 26 | 1 | 2.4951 | 2.675 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NaNO2 | ICSD | 60765 | Im2m (44) | ✗ | 4 | 26 | 1 | 2.6408 | 2.815 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NaNO2 | ICSD | 68707 | Imm2 (44) | ✗ | 4 | 26 | 1 | 2.4546 | 2.635 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TiCl2 | COD | 9009121 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.0 | 0.003 | 0.554 | (0;000) | ✗ | 27/01/17 |
| NaNO2 | ICSD | 76000 | Im2m (44) | ✗ | 4 | 26 | 1 | 2.5278 | 2.709 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ZnCl2 | COD | 9009136 | R-3m (166) | ✔ | 3 | 26 | 2 | 3.1235 | 3.189 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NaNO2 | ICSD | 43485 | Imm2 (44) | ✗ | 4 | 26 | 1 | 2.5378 | 2.720 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ZnI2 | COD | 9009122 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 1.4754 | 1.561 | 0.000 | (0;000) | ✗ | 30/01/17 |
| YBi | ICSD | 617246 | Fm-3m (225) | ✔ | 2 | 26 | 3 | 0.0 | 0.023 | 0.249 | (1;000) | ✗ | 05/01/17 |
| ZrGeSb | ICSD | 85000 | P4/nmm (129) | ✔ | 6 | 26 | 3 | 0.0 | 0.000 | 0.893 | (0;001) | ✗ | 27/01/17 |
| ZnI2 | ICSD | 48016 | P6/mmm (191) | ✔ | 3 | 26 | 3 | 0.0 | 0.089 | 0.339 | (0;000) | ✗ | 30/01/17 |
| ZnI2 | COD | 9009137 | R-3m (166) | ✔ | 3 | 26 | 2 | 1.1064 | 1.334 | 0.000 | (0;000) | ✗ | 30/01/17 |
| NaNO2 | ICSD | 4243 | Imm2 (44) | ✗ | 4 | 26 | 1 | 2.6518 | 2.828 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NaNO2 | ICSD | 280361 | Imm2 (44) | ✗ | 4 | 26 | 1 | 2.4411 | 2.622 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NaNO2 | ICSD | 9265 | Imm2 (44) | ✗ | 4 | 26 | 1 | 2.5403 | 2.720 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ScBi | ICSD | 58856 | Fm-3m (225) | ✔ | 2 | 26 | 3 | 0.0 | 0.008 | 0.261 | (1;000) | ✗ | 05/01/17 |
| SnS2 | COD | 9009120 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 1.4075 | 1.942 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NaNO2 | ICSD | 31824 | Imm2 (44) | ✗ | 4 | 26 | 1 | 1.8658 | 2.031 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Sb3Au | COD | 1510290 | Im-3m (229) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.613 | (1;000) | ✗ | 05/01/17 |
| NaNO2 | ICSD | 24626 | Im2m (44) | ✗ | 4 | 26 | 1 | 2.5161 | 2.698 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NaNO2 | ICSD | 200411 | Im2m (44) | ✗ | 4 | 26 | 1 | 2.4821 | 2.663 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na2LiN | COD | 1526569 | P6/mmm (191) | ✔ | 4 | 26 | 2 | 0.0 | 0.012 | 0.037 | (1;000) | ✗ | 27/01/17 |
| LiAl2Ir | COD | 1523425 | Fm-3m (225) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.832 | (1;000) | ✗ | 05/01/17 |
| BiI3 | ICSD | 187609 | Fm-3m (225) | ✔ | 4 | 26 | 3 | 0.0 | 0.002 | 0.318 | (0;000) | ✗ | 06/10/16 |
| NaNO2 | ICSD | 15400 | Imm2 (44) | ✗ | 4 | 26 | 1 | 2.5342 | 2.717 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BiF3 | ICSD | 24522 | Fm-3m (225) | ✔ | 4 | 26 | 3 | 2.9096 | 3.077 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Tl | COD | 9008518 | P6_3/mmc (194) | ✔ | 2 | 26 | 3 | 0.0 | 0.000 | 0.516 | (0;000) | ✗ | 27/01/17 |
| AlGaN2 | ICSD | 187055 | P-4m2 (115) | ✗ | 4 | 26 | 3 | 2.845 | 2.845 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BeAu2 | ICSD | 150581 | I4/mmm (139) | ✔ | 3 | 26 | 3 | 0.0 | 0.002 | 0.577 | (1;000) | ✗ | 05/01/17 |
| Cd(HO)2 | ICSD | 165224 | P-3m1 (164) | ✔ | 5 | 26 | 2 | 2.0673 | 2.296 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CdGeP2 | ICSD | 52804 | Fm-3m (225) | ✔ | 4 | 26 | 3 | 0.0 | 0.019 | 0.517 | (1;000) | ✗ | 27/01/17 |
| CdCl2 | COD | 9009125 | R-3m (166) | ✔ | 3 | 26 | 2 | 3.401 | 3.597 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NiB | ICSD | 26937 | Ccmm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.399 | (0;110) | ✗ | 06/10/16 |
| TiH | ICSD | 56181 | P4_2/mmc (131) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.468 | (0;011) | ✗ | 27/01/17 |
| CrB4 | COD | 1511720 | Immm (71) | ✔ | 5 | 26 | 3 | 0.0 | 0.015 | 0.101 | (1;111) | ✗ | 05/01/17 |
| CdCN2 | COD | 7222161 | R-3m (166) | ✔ | 4 | 26 | 3 | 2.4076 | 2.566 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiNO3 | COD | 1011340 | R-3m (166) | ✔ | 5 | 26 | 3 | 0.0 | 0.012 | 0.680 | (1;111) | ✗ | 27/01/17 |
| KZnAs | ICSD | 43985 | P-6m2 (187) | ✗ | 3 | 26 | 2 | 0.2099 | 0.326 | 0.000 | (0;000) | ✔ | 06/10/16 |
| LiAl2Rh | COD | 1523431 | Fm-3m (225) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.864 | (1;000) | ✗ | 05/01/17 |
| ZrAu2 | ICSD | 612510 | I4/mmm (139) | ✔ | 3 | 26 | 3 | 0.0 | 0.003 | 0.186 | (1;000) | ✗ | 05/01/17 |
| ZrAg2 | ICSD | 605995 | I4/mmm (139) | ✔ | 3 | 26 | 3 | 0.0 | 0.036 | 0.072 | (1;000) | ✗ | 05/01/17 |
| NaNO2 | ICSD | 174026 | Im2m (44) | ✗ | 4 | 26 | 1 | 2.5123 | 2.696 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AgCNO | ICSD | 27678 | Cmmm (65) | ✔ | 4 | 26 | 1 | 0.0 | 0.106 | 0.264 | (0;110) | ✗ | 27/01/17 |
| Cu2Se | ICSD | 30230 | F-43m (216) | ✗ | 3 | 28 | 3 | 0.0 | 0.000 | 0.097 | (1;000) | ✔ | 06/10/16 |
| LiGaO2 | ICSD | 28388 | R-3m (166) | ✔ | 4 | 28 | 2 | 4.0872 | 4.268 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CaSi | ICSD | 55209 | Cmcm (63) | ✔ | 4 | 28 | 3 | 0.0 | 0.012 | 0.176 | (1;000) | ✗ | 27/01/17 |
| YAl | ICSD | 247101 | Cmcm (63) | ✔ | 4 | 28 | 3 | 0.0 | 0.003 | 0.547 | (1;110) | ✗ | 05/01/17 |
| ScAl | ICSD | 609303 | Cmcm (63) | ✔ | 4 | 28 | 3 | 0.0 | 0.000 | 0.601 | (1;110) | ✗ | 05/01/17 |
| FeS | COD | 9011800 | P4/nmm (129) | ✔ | 4 | 28 | 2 | 0.0 | 0.026 | 0.459 | (0;000) | ✗ | 27/01/17 |
| FeTe | COD | 9008896 | P6_3/mmc (194) | ✔ | 4 | 28 | 3 | 0.0 | 0.016 | 0.359 | (1;000) | ✗ | 27/01/17 |