Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▴ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Be2C | COD | 9009053 | Fm-3m (225) | ✔ | 3 | 12 | 1 | 1.1755 | 4.135 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ca2As2O7 | ICSD | 32602 | C2/m (12) | ✔ | 11 | 72 | 1 | 4.0716 | 4.136 | 0.000 | (0;000) | ✗ | 05/01/17 |
| LiI | ICSD | 414242 | P6_3mc (186) | ✗ | 4 | 20 | 1 | 4.1367 | 4.137 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AlBr3 | ICSD | 83432 | P2_1/c (14) | ✔ | 16 | 96 | 1 | 4.1378 | 4.138 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Cs2KBiF6 | ICSD | 9383 | Fm-3m (225) | ✔ | 10 | 84 | 1 | 4.0251 | 4.138 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaC2N3 | COD | 4300181 | Pnma (62) | ✔ | 24 | 128 | 1 | 4.1109 | 4.141 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ge2N2O | ICSD | 169121 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 4.0068 | 4.143 | 0.000 | (0;000) | ✗ | 06/10/16 |
| H2C3F | COD | 4116821 | P2_1/c (14) | ✔ | 24 | 84 | 1 | 4.1064 | 4.146 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SiH3I | ICSD | 65044 | P2_1/c (14) | ✔ | 20 | 56 | 1 | 3.9747 | 4.155 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb2TiO3 | ICSD | 6101 | Cmce (64) | ✔ | 24 | 192 | 1 | 4.1346 | 4.155 | 0.000 | (0;000) | ✗ | 04/08/17 |
| LiIn(SiO3)2 | COD | 9008457 | C2/c (15) | ✔ | 20 | 120 | 3 | 4.0232 | 4.156 | 0.000 | (0;000) | ✗ | 02/02/17 |
| AlTlF4 | COD | 1000222 | P4/mmm (123) | ✔ | 6 | 44 | 2 | 4.0014 | 4.158 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AlB3N4 | ICSD | 187053 | P-43m (215) | ✗ | 8 | 32 | 3 | 4.1581 | 4.158 | 0.000 | (0;000) | ✗ | 06/10/16 |
| RbBr | ICSD | 61560 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 4.1418 | 4.159 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BaCrO4 | COD | 5910178 | Pnma (62) | ✔ | 24 | 192 | 1 | 4.1477 | 4.160 | 0.000 | (0;000) | ✗ | 04/08/17 |
| ScAsO4 | ICSD | 155920 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 4.1602 | 4.160 | 0.000 | (0;000) | ✗ | 05/01/17 |
| CaAl4O7 | COD | 3500014 | C2/c (15) | ✔ | 24 | 128 | 3 | 4.1612 | 4.161 | 0.000 | (0;000) | ✗ | 04/08/17 |
| LiBiF4 | ICSD | 65404 | I4_1/a (88) | ✔ | 12 | 92 | 3 | 4.0319 | 4.162 | 0.000 | (0;000) | ✗ | 05/01/17 |
| AsO2 | COD | 9007637 | Pnma (62) | ✔ | 24 | 136 | 3 | 4.0181 | 4.167 | 0.000 | (0;000) | ✗ | 04/08/17 |
| BN | ICSD | 162880 | Cc (9) | ✗ | 8 | 32 | 3 | 3.3515 | 4.168 | 0.000 | (0;000) | ✗ | 06/10/16 |
| NaAlAsO4F | COD | 1011040 | C2/c (15) | ✔ | 16 | 96 | 3 | 4.1684 | 4.168 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Na2SO3 | COD | 1010523 | P-3 (147) | ✔ | 12 | 84 | 1 | 4.0495 | 4.171 | 0.000 | (0;000) | ✗ | 27/01/17 |
| PbF2 | COD | 9009027 | Fm-3m (225) | ✔ | 3 | 28 | 3 | 4.0292 | 4.173 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Sr(AsO3)2 | ICSD | 420296 | P-31m (162) | ✔ | 9 | 56 | 2 | 3.8678 | 4.175 | 0.000 | (0;000) | ✗ | 05/01/17 |
| BaMg(CO3)2 | COD | 9011458 | R-3m (166) | ✔ | 10 | 64 | 2 | 4.0954 | 4.178 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ca(AsO3)2 | ICSD | 81064 | P-31m (162) | ✔ | 9 | 56 | 2 | 3.8558 | 4.178 | 0.000 | (0;000) | ✗ | 05/01/17 |
| As2O3 | COD | 4513566 | Fd-3m (227) | ✔ | 20 | 112 | 1 | 4.1418 | 4.179 | 0.000 | (0;000) | ✗ | 30/01/17 |
| SiO2 | COD | 1010921 | P2_13 (198) | ✗ | 24 | 128 | 3 | 4.1689 | 4.182 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SrSeO4 | COD | 9014342 | P2_1/c (14) | ✔ | 24 | 160 | 1 | 4.1668 | 4.182 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SeOF2 | COD | 4031233 | Pca2_1 (29) | ✗ | 16 | 104 | 1 | 4.1822 | 4.182 | 0.000 | (0;000) | ✗ | 22/03/17 |
| KScO2 | ICSD | 34958 | R-3m (166) | ✔ | 4 | 32 | 2 | 3.7269 | 4.188 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SrBe3O4 | ICSD | 26179 | P-62c (190) | ✗ | 16 | 92 | 1 | 4.1894 | 4.189 | 0.000 | (0;000) | ✗ | 15/02/17 |
| YClO | COD | 9009190 | P4/nmm (129) | ✔ | 6 | 48 | 3 | 4.19 | 4.190 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SrHfO3 | ICSD | 161594 | P4mm (99) | ✗ | 5 | 40 | 3 | 3.9464 | 4.190 | 0.000 | (0;000) | ✗ | 29/11/16 |
| B4CCl6O | ICSD | 280617 | R3m (160) | ✗ | 12 | 64 | 1 | 4.1136 | 4.192 | 0.000 | (0;000) | ✗ | 22/03/17 |
| As2O3 | COD | 9014252 | P2_1/c (14) | ✔ | 20 | 112 | 2 | 3.969 | 4.192 | 0.000 | (0;000) | ✗ | 30/01/17 |
| ZnSO4 | COD | 9009831 | Pnma (62) | ✔ | 24 | 168 | 3 | 4.1427 | 4.192 | 0.000 | (0;000) | ✗ | 04/08/17 |
| KSrCO3F | ICSD | 262231 | P-6m2 (187) | ✗ | 7 | 48 | 1 | 4.1919 | 4.195 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Mg2SiO4 | COD | 9000275 | I4/mmm (139) | ✔ | 7 | 48 | 3 | 3.7368 | 4.199 | 0.000 | (0;000) | ✗ | 27/01/17 |
| MgH2SeO5 | ICSD | 66745 | C2/c (15) | ✔ | 18 | 96 | 3 | 4.2015 | 4.202 | 0.000 | (0;000) | ✗ | 27/01/17 |
| RbBr | COD | 9008706 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 4.2029 | 4.203 | 0.000 | (0;000) | ✗ | 27/01/17 |
| H2CBr2 | COD | 2100676 | C2/c (15) | ✔ | 20 | 80 | 1 | 4.1172 | 4.203 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SrCa(CO3)2 | ICSD | 201461 | Pmc2_1 (26) | ✗ | 20 | 128 | 1 | 4.2035 | 4.204 | 0.000 | (0;000) | ✗ | 21/03/17 |
| PbF2 | COD | 2310346 | Pnma (62) | ✔ | 12 | 112 | 3 | 3.9763 | 4.204 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ca(CO)4 | ICSD | 248078 | I4_1/amd (141) | ✔ | 18 | 100 | 1 | 4.1602 | 4.205 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Li2S | COD | 9009060 | Fm-3m (225) | ✔ | 3 | 12 | 1 | 3.3651 | 4.208 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Si(CN2)2 | COD | 1526364 | Pn-3m (224) | ✔ | 14 | 64 | 3 | 4.2091 | 4.209 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Zn(H4N5)2 | ICSD | 421952 | P-1 (2) | ✔ | 19 | 70 | 1 | 4.165 | 4.209 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiAsO3 | COD | 1529820 | R-3 (148) | ✔ | 10 | 52 | 1 | 4.0057 | 4.210 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Cs(BH)3 | ICSD | 65508 | Fm-3m (225) | ✔ | 14 | 42 | 2 | 4.0127 | 4.210 | 0.000 | (0;000) | ✗ | 02/02/17 |