Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| BaTiO3 | ICSD | 100464 | R3m (160) | ✗ | 5 | 40 | 3 | 2.2876 | 2.569 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AlAuO2 | COD | 1531586 | P6_3/mmc (194) | ✔ | 8 | 52 | 3 | 0.5094 | 1.563 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AlAu | COD | 1523318 | P2_1/m (11) | ✔ | 8 | 56 | 3 | 0.0 | 0.126 | 0.308 | (1;000) | ✗ | 05/01/17 |
| Al2O3 | ICSD | 173014 | P1 (1) | ✗ | 10 | 48 | 3 | 0.0 | 0.285 | 1.000 | (0;000) | ✔ | 06/10/16 |
| HgTe | ICSD | 639251 | P3_221 (154) | ✗ | 6 | 54 | 3 | 0.0 | 0.028 | 0.057 | (0;000) | ✔ | 06/10/16 |
| TiAlAu | ICSD | 57506 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.0 | 0.011 | 0.745 | (1;000) | ✗ | 05/01/17 |
| BaTiO3 | ICSD | 154346 | C2mm (38) | ✗ | 5 | 40 | 3 | 0.0 | 0.012 | 0.529 | (0;110) | ✔ | 28/11/16 |
| BaTiO3 | ICSD | 161341 | C2mm (38) | ✗ | 5 | 40 | 3 | 0.0 | 0.002 | 0.621 | (1;011) | ✔ | 06/10/16 |
| AlBMo | COD | 1528606 | Cmcm (63) | ✔ | 6 | 40 | 3 | 0.0 | 0.020 | 0.209 | (1;110) | ✗ | 05/01/17 |
| AlBO3 | COD | 9011182 | R-3c (167) | ✔ | 10 | 48 | 3 | 5.9642 | 6.081 | 0.000 | (0;000) | ✗ | 05/01/17 |
| V3GaN | ICSD | 634723 | Cmcm (63) | ✔ | 10 | 114 | 3 | 0.0 | 0.000 | 0.670 | (0;110) | ✗ | 27/01/17 |
| Li2GaIr | COD | 1527262 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.004 | 0.477 | (1;000) | ✗ | 27/01/17 |
| ZrGa2 | COD | 1522709 | Cmmm (65) | ✔ | 6 | 60 | 3 | 0.0 | 0.017 | 0.480 | (1;110) | ✗ | 27/01/17 |
| ScGa2 | COD | 1522720 | Cmmm (65) | ✔ | 6 | 74 | 3 | 0.0 | 0.017 | 0.510 | (1;001) | ✗ | 27/01/17 |
| Ga2Ru | ICSD | 635228 | Fddd (70) | ✔ | 6 | 84 | 3 | 0.0567 | 0.830 | 0.000 | (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 |
| BaTiO3 | ICSD | 161419 | C2mm (38) | ✗ | 5 | 40 | 3 | 0.0 | 0.012 | 0.481 | (0;000) | ✔ | 06/10/16 |
| CaAlSiO4F | ICSD | 87663 | C2/c (15) | ✔ | 16 | 96 | 3 | 5.4487 | 5.449 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Ga2Pt | COD | 9009033 | Fm-3m (225) | ✔ | 3 | 36 | 3 | 0.0 | 0.050 | 0.831 | (0;000) | ✗ | 27/01/17 |
| BaTiO3 | ICSD | 186460 | C2mm (38) | ✗ | 5 | 40 | 3 | 1.9349 | 2.048 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Al2O3 | ICSD | 82504 | C2/m (12) | ✔ | 10 | 48 | 3 | 4.5944 | 4.693 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Bi2Rh | ICSD | 43503 | P2_1/c (14) | ✔ | 12 | 188 | 3 | 0.0 | 0.014 | 0.221 | (0;101) | ✗ | 02/02/17 |
| BaTiO3 | ICSD | 186461 | R3m (160) | ✗ | 5 | 40 | 3 | 2.0696 | 2.225 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MnAlCo2 | ICSD | 606611 | Fm-3m (225) | ✔ | 4 | 52 | 3 | 0.0 | 0.007 | 0.260 | (0;000) | ✗ | 05/01/17 |
| NbAlCo2 | ICSD | 606622 | Fm-3m (225) | ✔ | 4 | 50 | 3 | 0.0 | 0.000 | 0.686 | (1;000) | ✗ | 05/01/17 |
| BaTiO3 | ICSD | 186462 | R3m (160) | ✗ | 5 | 40 | 3 | 2.5037 | 2.909 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Pd(PbBr3)2 | ICSD | 78874 | P2_1/c (14) | ✔ | 18 | 176 | 3 | 1.2748 | 1.375 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TaAlCo2 | ICSD | 57634 | Fm-3m (225) | ✔ | 4 | 50 | 3 | 0.0 | 0.000 | 0.645 | (1;000) | ✗ | 05/01/17 |
| AlVCo2 | ICSD | 606704 | Fm-3m (225) | ✔ | 4 | 50 | 3 | 0.0 | 0.000 | 0.658 | (1;000) | ✗ | 05/01/17 |
| Zr3Ga2 | COD | 1522710 | P4/mbm (127) | ✔ | 10 | 76 | 3 | 0.0 | 0.006 | 0.823 | (0;001) | ✗ | 27/01/17 |
| ScGa2 | COD | 1523235 | Imma (74) | ✔ | 6 | 74 | 3 | 0.0 | 0.001 | 0.639 | (1;101) | ✗ | 27/01/17 |
| BaTiO3 | ICSD | 186463 | R3m (160) | ✗ | 5 | 40 | 3 | 2.5683 | 2.945 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CsAlO2 | ICSD | 28372 | Fd-3m (227) | ✔ | 8 | 48 | 3 | 4.8428 | 4.850 | 0.000 | (0;000) | ✗ | 05/01/17 |
| MnAlCu2 | COD | 5910083 | Fm-3m (225) | ✔ | 4 | 40 | 3 | 0.0 | 0.031 | 0.192 | (1;000) | ✗ | 05/01/17 |
| BaTiO3 | ICSD | 237106 | Cm2m (38) | ✗ | 5 | 40 | 3 | 1.9647 | 2.195 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Al(ReCu)2 | ICSD | 57706 | P4/mbm (127) | ✔ | 10 | 110 | 3 | 0.0 | 0.000 | 0.822 | (1;000) | ✗ | 05/01/17 |
| ScAlCu2 | ICSD | 57709 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.015 | 0.236 | (1;000) | ✗ | 05/01/17 |
| Ta3Ga2 | ICSD | 635467 | P4/mbm (127) | ✔ | 10 | 130 | 3 | 0.0 | 0.000 | 0.881 | (0;111) | ✗ | 27/01/17 |
| BaTiO3 | ICSD | 237109 | Cm2m (38) | ✗ | 5 | 40 | 3 | 1.7918 | 1.910 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AlCu3 | ICSD | 150823 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.000 | 0.879 | (0;000) | ✗ | 05/01/17 |
| AlCu | ICSD | 653749 | C2/m (12) | ✔ | 10 | 70 | 3 | 0.0 | 0.007 | 0.723 | (0;110) | ✗ | 05/01/17 |
| BaTiO3 | ICSD | 31155 | C2mm (38) | ✗ | 5 | 40 | 3 | 1.9813 | 2.199 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AlCuO2 | ICSD | 188313 | R-3m (166) | ✔ | 4 | 26 | 3 | 1.9048 | 2.661 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AlCuO2 | COD | 1531583 | P6_3/mmc (194) | ✔ | 8 | 52 | 3 | 1.9892 | 2.478 | 0.000 | (0;000) | ✗ | 05/01/17 |
| CdHgSBr | ICSD | 185392 | Cmmm (65) | ✔ | 16 | 148 | 3 | 0.0 | 0.002 | 0.764 | (0;000) | ✗ | 02/02/17 |
| CdSbS2Br | ICSD | 171723 | C2/m (12) | ✔ | 10 | 72 | 3 | 1.4947 | 1.517 | 0.000 | (0;000) | ✗ | 02/02/17 |
| InGaSe2 | ICSD | 601131 | I4/mcm (140) | ✔ | 8 | 76 | 3 | 0.0 | 0.029 | 0.126 | (0;000) | ✗ | 27/01/17 |
| Ga4GeO8 | COD | 1001682 | C2/m (12) | ✔ | 13 | 104 | 3 | 2.4626 | 2.475 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Pd2Cl2O | ICSD | 61333 | I4_1/amd (141) | ✔ | 10 | 112 | 3 | 0.8284 | 1.027 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TaN | ICSD | 290395 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.080 | (1;100) | ✔ | 04/10/16 |
| AlCuPt2 | ICSD | 107788 | P4/mmm (123) | ✔ | 4 | 34 | 3 | 0.0 | 0.101 | 0.248 | (1;111) | ✗ | 05/01/17 |
| CuHgSeBr | ICSD | 411771 | Pmma (51) | ✔ | 16 | 144 | 3 | 0.8098 | 0.868 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CuBr | COD | 9013934 | Pa3 (205) | ✔ | 16 | 144 | 3 | 0.2961 | 0.296 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BaTiO3 | ICSD | 6102 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3587 | 2.658 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CuSe3Br | COD | 1524480 | Pmna (53) | ✔ | 20 | 144 | 3 | 0.8867 | 1.006 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BaTiO3 | ICSD | 73628 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3799 | 2.685 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ReB | COD | 1511506 | I4_1/amd (141) | ✔ | 16 | 144 | 3 | 0.0 | 0.003 | 0.609 | (1;111) | ✗ | 02/02/17 |
| AlF3 | ICSD | 130021 | Pm-3m (221) | ✔ | 4 | 24 | 3 | 7.6687 | 8.500 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AlF3 | COD | 1000467 | R-3c (167) | ✔ | 8 | 48 | 3 | 8.0575 | 8.058 | 0.000 | (0;000) | ✗ | 05/01/17 |
| ZrGa3 | ICSD | 635698 | I4/mmm (139) | ✔ | 8 | 86 | 3 | 0.0 | 0.010 | 0.714 | (1;000) | ✗ | 27/01/17 |
| ScGa3 | COD | 1523115 | Pm-3m (221) | ✔ | 4 | 50 | 3 | 0.0 | 0.001 | 0.397 | (0;111) | ✗ | 27/01/17 |
| BaTiO3 | ICSD | 73629 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3638 | 2.665 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NbGa3 | COD | 1522506 | I4/mmm (139) | ✔ | 4 | 52 | 3 | 0.0 | 0.005 | 0.153 | (1;000) | ✗ | 27/01/17 |
| Ti2Ga3 | COD | 1522704 | P4/m (83) | ✔ | 10 | 126 | 3 | 0.0 | 0.000 | 0.704 | (1;111) | ✗ | 27/01/17 |
| BaTiO3 | ICSD | 73630 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4221 | 2.737 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TaGa3 | COD | 1522718 | I4/mmm (139) | ✔ | 4 | 52 | 3 | 0.0 | 0.010 | 0.165 | (1;000) | ✗ | 27/01/17 |
| InGaO3 | ICSD | 30339 | P6_3/mmc (194) | ✔ | 10 | 88 | 3 | 1.6994 | 1.915 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ga5Ni | ICSD | 165723 | I4/mcm (140) | ✔ | 12 | 150 | 3 | 0.0 | 0.001 | 0.474 | (1;000) | ✗ | 27/01/17 |
| HPbBrO | ICSD | 404573 | Pnma (62) | ✔ | 16 | 112 | 3 | 2.8066 | 2.835 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SrGa4 | COD | 1522272 | I4/mmm (139) | ✔ | 5 | 62 | 3 | 0.0 | 0.011 | 0.237 | (1;000) | ✗ | 27/01/17 |
| InSb2S4Br | ICSD | 159467 | C2/m (12) | ✔ | 16 | 108 | 3 | 1.4395 | 1.453 | 0.000 | (0;000) | ✗ | 02/02/17 |
| InSb2Se4Br | ICSD | 159466 | C2/m (12) | ✔ | 16 | 108 | 3 | 1.014 | 1.016 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BaTiO3 | ICSD | 73631 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4036 | 2.716 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Hf(VGa2)2 | ICSD | 634333 | I4/mmm (139) | ✔ | 7 | 90 | 3 | 0.0 | 0.004 | 0.290 | (1;000) | ✗ | 27/01/17 |
| MnSbS2Br | ICSD | 172782 | C2/m (12) | ✔ | 10 | 78 | 3 | 0.0 | 0.002 | 0.364 | (1;111) | ✗ | 02/02/17 |
| MnSbSe2Br | ICSD | 172784 | Pnma (62) | ✔ | 20 | 156 | 3 | 0.0 | 0.000 | 0.378 | (1;011) | ✗ | 02/02/17 |
| Mo3S3Br | COD | 1525071 | R-3 (148) | ✔ | 14 | 134 | 3 | 0.0 | 0.002 | 0.636 | (0;111) | ✗ | 02/02/17 |
| Zr(VGa2)2 | ICSD | 635647 | I4/mmm (139) | ✔ | 7 | 82 | 3 | 0.0 | 0.002 | 0.271 | (1;000) | ✗ | 27/01/17 |
| Y3BrO4 | ICSD | 419384 | Cmcm (63) | ✔ | 16 | 128 | 3 | 4.3204 | 4.320 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BaTiO3 | ICSD | 73632 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3277 | 2.617 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Zr(TiGa2)2 | ICSD | 635567 | I4/mmm (139) | ✔ | 7 | 80 | 3 | 0.0 | 0.000 | 0.621 | (0;000) | ✗ | 27/01/17 |
| Tl5Se2Br | ICSD | 75960 | I4/mcm (140) | ✔ | 16 | 168 | 3 | 0.1085 | 0.117 | 0.000 | (0;000) | ✗ | 02/02/17 |
| GaHO2 | COD | 8100298 | Pnma (62) | ✔ | 16 | 104 | 3 | 3.5929 | 3.638 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Tl5Te2Br | ICSD | 427679 | I4/mcm (140) | ✔ | 16 | 168 | 3 | 0.0633 | 0.064 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TaBRu | ICSD | 429116 | Pmma (51) | ✔ | 18 | 192 | 3 | 0.0 | 0.012 | 0.833 | (1;010) | ✗ | 02/02/17 |
| Tl3BS3 | COD | 1511323 | P2_1/m (11) | ✔ | 14 | 120 | 3 | 0.9641 | 1.129 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BaTiO3 | ICSD | 73633 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4045 | 2.715 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MnGaGe | ICSD | 634255 | P4/nmm (129) | ✔ | 6 | 64 | 3 | 0.0 | 0.012 | 0.201 | (0;001) | ✗ | 27/01/17 |
| Zr5Sn3B | ICSD | 656289 | P6_3/mcm (193) | ✔ | 18 | 130 | 3 | 0.0 | 0.000 | 0.765 | (1;000) | ✗ | 02/02/17 |
| Hf2Ga | COD | 1524524 | I4/mcm (140) | ✔ | 6 | 74 | 3 | 0.0 | 0.001 | 0.721 | (0;111) | ✗ | 27/01/17 |
| AlFeF5 | COD | 1000363 | Immm (71) | ✔ | 7 | 46 | 3 | 0.0 | 0.098 | 0.084 | (0;000) | ✗ | 05/01/17 |
| BaTiO3 | ICSD | 73634 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3562 | 2.657 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ti2GaN | ICSD | 634721 | P6_3/mmc (194) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.525 | (1;000) | ✗ | 27/01/17 |
| Ge2Mo | ICSD | 76139 | I4/mmm (139) | ✔ | 3 | 22 | 3 | 0.0 | 0.051 | 0.327 | (1;111) | ✗ | 27/01/17 |
| LiGa | COD | 1523146 | Fd-3m (227) | ✔ | 4 | 32 | 3 | 0.0 | 0.013 | 0.218 | (0;000) | ✗ | 27/01/17 |
| Al2Se3 | ICSD | 14373 | Cc (9) | ✗ | 10 | 48 | 3 | 1.5341 | 1.554 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CsNiC2BrN2 | ICSD | 380468 | I4/mmm (139) | ✔ | 14 | 88 | 3 | 0.0 | 0.012 | 0.283 | (0;000) | ✗ | 02/02/17 |
| RbNiC2BrN2 | ICSD | 380470 | I4/mmm (139) | ✔ | 14 | 88 | 3 | 0.0 | 0.009 | 0.315 | (0;000) | ✗ | 02/02/17 |
| MnAlF5 | COD | 1000348 | Cmcm (63) | ✔ | 14 | 106 | 3 | 0.0 | 0.000 | 0.396 | (0;000) | ✗ | 05/01/17 |
| BaTiO3 | ICSD | 73635 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3746 | 2.677 | 0.000 | (0;000) | ✗ | 06/10/16 |