| ▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Cr2P | COD | 1008867 | Imm2 (44) | ✗ | 18 | 198 | 3 | 28.0232 | 0.005 | 1.000 | (0;000) | ✗ | 22/03/17 |
| NaClO3 | COD | 1010057 | P2_13 (198) | ✗ | 20 | 136 | 1 | 1.1406 | 1.153 | 0.000 | (0;000) | ✗ | 22/03/17 |
| ZnCl2 | COD | 4343817 | Pna2_1 (33) | ✗ | 12 | 104 | 3 | 3.8314 | 3.832 | 0.000 | (0;000) | ✗ | 22/03/17 |
| CsICl2 | COD | 2106471 | R-3m (166) | ✔ | 4 | 30 | 1 | 2.1106 | 2.293 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Hg3(SCl)2 | COD | 9011080 | I2_13 (199) | ✗ | 14 | 124 | 3 | 2.0084 | 2.031 | 0.000 | (0;000) | ✗ | 22/03/17 |
| IClO | COD | 9009192 | Pmmn (59) | ✔ | 6 | 40 | 2 | 0.0 | 0.054 | 0.575 | (0;000) | ✗ | 22/03/17 |
| Si5(H2Cl)4 | COD | 4329335 | I-4 (82) | ✗ | 17 | 56 | 2 | 3.7699 | 3.770 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Sr2CuClO2 | COD | 2002855 | P3_121 (152) | ✗ | 18 | 150 | 1 | 2.4019 | 2.593 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Sr3Cr2O8 | COD | 2002131 | R-3m (166) | ✔ | 13 | 106 | 1 | 0.0 | 0.000 | 0.246 | (1;111) | ✗ | 22/03/17 |
| AgC4N3 | COD | 7115405 | Ima2 (46) | ✗ | 16 | 84 | 3 | 3.6159 | 3.621 | 0.000 | (0;000) | ✗ | 21/03/17 |
| NaClO3 | COD | 1010513 | P2_13 (198) | ✗ | 20 | 136 | 1 | 1.9432 | 2.031 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Ba3CrS5 | COD | 1533192 | P6_3cm (185) | ✗ | 18 | 148 | 1 | 0.0 | 0.000 | 0.838 | ? | ✗ | 21/03/17 |
| CoSi | COD | 1010036 | P2_13 (198) | ✗ | 8 | 84 | 3 | 0.0 | 0.000 | 0.126 | (1;000) | ✔ | 22/03/17 |
| YCo3 | COD | 2310314 | R-3m (166) | ✔ | 12 | 186 | 3 | 0.0 | 0.000 | 0.799 | (1;000) | ✗ | 22/03/17 |
| Na4CoO3 | COD | 1523213 | Cc (9) | ✗ | 16 | 142 | 3 | 0.0 | 0.002 | 0.670 | ? | ✗ | 22/03/17 |
| MnNb3O6 | COD | 1519036 | Immm (71) | ✔ | 20 | 180 | 3 | 0.0 | 0.007 | 0.314 | (0;000) | ✗ | 29/03/17 |
| Zn3Ga4Pd7 | COD | 1522962 | R3 (146) | ✗ | 14 | 214 | 3 | 0.0 | 0.000 | 0.719 | ? | ✗ | 22/03/17 |
| KSb4F13 | COD | 5910285 | I4/m (87) | ✔ | 18 | 120 | 1 | 0.0 | 2.514 | 1.000 | (0;000) | ✗ | 22/03/17 |
| CsPbI3 | COD | 4335639 | Pnma (62) | ✔ | 20 | 176 | 2 | 1.8656 | 1.893 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Ti2CrO5 | COD | 2002414 | C2/c (15) | ✔ | 16 | 136 | 3 | 0.0 | 0.004 | 0.425 | (0;000) | ✗ | 22/03/17 |
| RbLiCrO4 | COD | 2100905 | P31c (159) | ✗ | 14 | 100 | 1 | 3.1623 | 3.225 | 0.000 | (0;000) | ✗ | 22/03/17 |
| CrReO4 | COD | 1528741 | C2/m (12) | ✔ | 12 | 106 | 3 | 0.0 | 0.026 | 0.770 | (0;111) | ✗ | 22/03/17 |
| CsH3O2 | COD | 2012559 | I4_1/amd (141) | ✔ | 12 | 48 | 3 | 4.5945 | 4.737 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Cs2HgI4 | COD | 1526210 | P2_1 (4) | ✗ | 14 | 116 | 1 | 1.8375 | 1.838 | 0.000 | (0;000) | ✗ | 22/03/17 |
| CsSb4F13 | COD | 5910189 | I4/m (87) | ✔ | 18 | 120 | 3 | 2.4393 | 2.443 | 0.000 | (0;000) | ✗ | 22/03/17 |