| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▴ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| V2ZnO6 | ICSD | 26998 | C2 (5) | ✗ | 9 | 74 | 3 | 2.1247 | 2.204 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K2AgSb | ICSD | 1155 | C222_1 (20) | ✗ | 8 | 68 | 1 | 1.1247 | 1.333 | 0.000 | (0;000) | ✗ | 06/10/16 |
| V2Pb3O8 | ICSD | 29359 | C2 (5) | ✗ | 13 | 116 | 3 | 2.3727 | 2.545 | 0.000 | (0;000) | ✗ | 06/10/16 |
| V2Pb3O8 | ICSD | 67604 | C2 (5) | ✗ | 13 | 116 | 3 | 2.7495 | 2.762 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BaSe3 | ICSD | 16359 | P-42_1m (113) | ✗ | 8 | 56 | 1 | 0.9646 | 1.065 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CuI | ICSD | 157431 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.9584 | 0.959 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AgNO2 | ICSD | 23891 | Imm2 (44) | ✗ | 4 | 28 | 3 | 1.7804 | 2.251 | 0.000 | (0;000) | ✗ | 06/10/16 |
| V2Pb3O8 | ICSD | 67605 | C2 (5) | ✗ | 13 | 116 | 3 | 2.725 | 2.737 | 0.000 | (0;000) | ✗ | 06/10/16 |
| V2Pb3O8 | ICSD | 69800 | C2 (5) | ✗ | 13 | 116 | 3 | 2.5077 | 2.573 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AgNO2 | ICSD | 24378 | Im2m (44) | ✗ | 4 | 28 | 3 | 1.5099 | 1.922 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TeSeO4 | ICSD | 201413 | P1 (1) | ✗ | 12 | 72 | 3 | 3.0537 | 3.293 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AgNO2 | ICSD | 26750 | Imm2 (44) | ✗ | 4 | 28 | 3 | 1.5341 | 1.989 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AgNO3 | ICSD | 35157 | R3m (160) | ✗ | 5 | 34 | 3 | 2.0793 | 2.425 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Si3P2Pt | ICSD | 84944 | P1 (1) | ✗ | 12 | 64 | 3 | 0.6365 | 1.195 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Si4P4Ru | ICSD | 79006 | P1 (1) | ✗ | 9 | 52 | 3 | 1.442 | 1.660 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CuI | ICSD | 24772 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.9338 | 0.934 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AgNO3 | ICSD | 374 | R3c (161) | ✗ | 10 | 68 | 3 | 1.7072 | 1.921 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TaAgO3 | ICSD | 40830 | R3c (161) | ✗ | 10 | 84 | 3 | 2.0218 | 2.039 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Sb2Te4Pb | ICSD | 250250 | R-3m (166) | ✔ | 7 | 48 | 2 | 0.1535 | 0.154 | 0.000 | (1;111) | ✗ | 02/02/17 |
| AlAs | ICSD | 67771 | P6_3mc (186) | ✗ | 4 | 16 | 3 | 1.599 | 1.705 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CuI | ICSD | 84217 | P3m1 (156) | ✗ | 4 | 36 | 2 | 1.3365 | 1.337 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AsI3 | ICSD | 23003 | R-3 (148) | ✔ | 8 | 52 | 1 | 1.9506 | 2.019 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ag2GeS3 | ICSD | 41711 | Cmc2_1 (36) | ✗ | 12 | 88 | 3 | 0.1033 | 0.103 | 0.000 | (0;000) | ✔ | 28/11/16 |
| SiPtSe | ICSD | 649595 | P2_1ab (29) | ✗ | 12 | 80 | 3 | 0.661 | 0.803 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ag2HgI4 | ICSD | 150343 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.0055 | 1.006 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbRhS | ICSD | 650233 | P2_13 (198) | ✗ | 12 | 112 | 3 | 1.0306 | 1.277 | 0.000 | (0;000) | ✗ | 06/10/16 |
| B6P | ICSD | 615157 | R-3m (166) | ✔ | 14 | 46 | 3 | 2.3732 | 2.493 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Ag2HgI4 | ICSD | 25592 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.0077 | 1.008 | 0.000 | (0;000) | ✗ | 06/10/16 |
| RuS2 | COD | 9016356 | Pa3 (205) | ✔ | 12 | 112 | 3 | 0.7339 | 0.971 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ag2HgI4 | ICSD | 6069 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.0269 | 1.027 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ag2TeS3 | ICSD | 85135 | Cc (9) | ✗ | 12 | 92 | 3 | 1.0746 | 1.075 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Tl3SbS3 | ICSD | 48133 | R3m (160) | ✗ | 7 | 62 | 3 | 1.2263 | 1.230 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ag3SI | ICSD | 159858 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4293 | 0.829 | 0.000 | (0;000) | ✔ | 06/10/16 |
| TaTl3S4 | ICSD | 16571 | I-43m (217) | ✗ | 8 | 76 | 1 | 1.8689 | 2.059 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TaTl3S4 | ICSD | 600247 | I-43m (217) | ✗ | 8 | 76 | 1 | 1.8678 | 2.058 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Te2Ru | COD | 1528256 | Pnnm (58) | ✔ | 6 | 56 | 3 | 0.2 | 1.021 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BaTe3 | ICSD | 36366 | P-42_1m (113) | ✗ | 8 | 56 | 1 | 0.719 | 0.730 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CuP2 | ICSD | 35282 | P2_1/c (14) | ✔ | 12 | 84 | 2 | 0.8655 | 0.866 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ScTlS2 | ICSD | 418474 | P6_3/mmc (194) | ✔ | 8 | 72 | 2 | 0.725 | 1.667 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SiS2 | COD | 1010409 | Ibam (72) | ✔ | 6 | 32 | 1 | 2.6018 | 2.896 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SnS2 | COD | 9009120 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 1.4075 | 1.942 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ag3SI | ICSD | 174095 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4293 | 0.829 | 0.000 | (0;000) | ✔ | 06/10/16 |
| TaTl3S4 | ICSD | 651107 | I-43m (217) | ✗ | 8 | 76 | 1 | 1.8644 | 2.054 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Tl3VS4 | ICSD | 16572 | I-43m (217) | ✗ | 8 | 76 | 3 | 1.4009 | 1.401 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ag3SI | ICSD | 201005 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4545 | 1.022 | 0.000 | (0;000) | ✔ | 28/11/16 |
| YTlS2 | ICSD | 651267 | R-3m (166) | ✔ | 4 | 36 | 2 | 1.4802 | 2.223 | 0.000 | (0;000) | ✗ | 27/01/17 |
| ZrS2 | COD | 5910006 | P-3m1 (164) | ✔ | 3 | 16 | 2 | 0.535 | 1.254 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Tl3VS4 | ICSD | 200270 | I-43m (217) | ✗ | 8 | 76 | 3 | 1.8328 | 1.833 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TiS3 | COD | 1520546 | P2_1/m (11) | ✔ | 8 | 60 | 2 | 0.2822 | 0.309 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Tl3VS4 | ICSD | 600245 | I-43m (217) | ✗ | 8 | 76 | 3 | 1.4025 | 1.403 | 0.000 | (0;000) | ✗ | 06/10/16 |