Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| B4PbO7 | ICSD | 185673 | Pmn2_1 (31) | ✗ | 24 | 136 | 3 | 3.7884 | 4.333 | 0.000 | (0;000) | ✗ | 04/08/17 |
| GaCl2 | ICSD | 62664 | Pnna (52) | ✔ | 24 | 216 | 1 | 3.7899 | 3.803 | 0.000 | (0;000) | ✗ | 04/08/17 |
| BaZnBO3F | ICSD | 248042 | P-6 (174) | ✗ | 7 | 50 | 3 | 3.7899 | 4.365 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Mg3NF3 | COD | 1528307 | Pm-3m (221) | ✔ | 7 | 56 | 3 | 3.7906 | 3.791 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K3VO4 | ICSD | 4138 | I-42m (121) | ✗ | 8 | 64 | 3 | 3.7908 | 3.933 | 0.000 | (0;000) | ✗ | 07/10/16 |
| LiNbO3 | ICSD | 247734 | R3c (161) | ✗ | 10 | 68 | 3 | 3.7912 | 3.902 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ca3TeO6 | ICSD | 16362 | P2_1/c (14) | ✔ | 20 | 144 | 1 | 3.7915 | 4.049 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiTaO3 | ICSD | 108874 | R3c (161) | ✗ | 10 | 68 | 3 | 3.7915 | 3.820 | 0.000 | (0;000) | ✗ | 06/10/16 |
| HC3F2 | COD | 4116823 | P2_1/c (14) | ✔ | 24 | 108 | 2 | 3.7951 | 4.119 | 0.000 | (0;000) | ✗ | 04/08/17 |
| LiN3 | ICSD | 34675 | C2/m (12) | ✔ | 4 | 18 | 1 | 3.7952 | 4.288 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CIF3 | ICSD | 73268 | Cmce (64) | ✔ | 20 | 128 | 1 | 3.7955 | 3.808 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SrAl4O7 | COD | 9007445 | C2/c (15) | ✔ | 24 | 128 | 3 | 3.7973 | 3.797 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Pb7(ClF6)2 | COD | 1523195 | P-6 (174) | ✗ | 21 | 196 | 3 | 3.7981 | 3.847 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Li2W2O7 | COD | 2106564 | P-1 (2) | ✔ | 22 | 208 | 1 | 3.7985 | 3.863 | 0.000 | (0;000) | ✗ | 07/08/17 |
| LiIO3 | ICSD | 40362 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.7988 | 3.879 | 0.000 | (0;000) | ✗ | 29/11/16 |
| LiTaO3 | ICSD | 84579 | R3c (161) | ✗ | 10 | 68 | 3 | 3.7989 | 3.825 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cs2CdFe(CN)6 | ICSD | 151696 | Fm-3m (225) | ✔ | 16 | 92 | 3 | 3.799 | 3.888 | 0.000 | (0;000) | ✗ | 02/02/17 |
| InPH2O5 | COD | 9012528 | P-1 (2) | ✔ | 18 | 100 | 3 | 3.7997 | 3.887 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ca2Al2O5 | COD | 9002389 | Ima2 (46) | ✗ | 18 | 112 | 3 | 3.8003 | 3.800 | 0.000 | (0;000) | ✗ | 16/03/17 |
| LiTaO3 | ICSD | 164259 | R3c (161) | ✗ | 10 | 68 | 3 | 3.8017 | 3.828 | 0.000 | (0;000) | ✗ | 06/10/16 |
| H2O | COD | 1011063 | C222_1 (20) | ✗ | 12 | 32 | 3 | 3.802 | 4.116 | 0.000 | (0;000) | ✗ | 15/02/17 |
| LiIO3 | ICSD | 46027 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.8029 | 3.878 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Sr2YSbO6 | ICSD | 157886 | Fm-3m (225) | ✔ | 10 | 72 | 3 | 3.803 | 3.803 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiH3O2 | COD | 2106174 | C2/m (12) | ✔ | 12 | 36 | 1 | 3.8048 | 3.883 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NaReO4 | ICSD | 52337 | I4_1/a (88) | ✔ | 12 | 96 | 1 | 3.8048 | 3.880 | 0.000 | (0;000) | ✗ | 27/01/17 |
| GeO2 | COD | 1525835 | Pa3 (205) | ✔ | 12 | 64 | 3 | 3.8052 | 3.805 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Sr(AlS2)2 | ICSD | 609259 | Cccm (66) | ✔ | 14 | 80 | 1 | 3.807 | 3.844 | 0.000 | (0;000) | ✗ | 30/01/17 |
| ZnCl2 | ICSD | 26152 | P4_2/nmc (137) | ✔ | 6 | 52 | 2 | 3.8088 | 3.809 | 0.000 | (0;000) | ✗ | 27/01/17 |
| InH4NCl4 | ICSD | 419830 | I4_1/a (88) | ✔ | 20 | 100 | 1 | 3.811 | 3.811 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sn3PO4F3 | ICSD | 37133 | R3 (146) | ✗ | 11 | 92 | 3 | 3.8127 | 3.853 | 0.000 | (0;000) | ✗ | 15/02/17 |
| LiIO3 | ICSD | 9508 | P6_3 (173) | ✗ | 10 | 56 | 1 | 3.8139 | 3.877 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ZnH8(N2Cl)2 | ICSD | 15875 | C2/m (12) | ✔ | 15 | 54 | 2 | 3.8143 | 4.554 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiTaO3 | ICSD | 9537 | R3c (161) | ✗ | 10 | 68 | 3 | 3.8149 | 3.837 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K2LiBO3 | ICSD | 60949 | C2 (5) | ✗ | 14 | 84 | 1 | 3.8165 | 3.823 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Cs3TlF6 | COD | 1529658 | I4/mmm (139) | ✔ | 10 | 82 | 3 | 3.8175 | 4.134 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiAlAs2O7 | ICSD | 161498 | C2 (5) | ✗ | 11 | 58 | 3 | 3.8176 | 3.895 | 0.000 | (0;000) | ✗ | 15/02/17 |
| SiO2 | ICSD | 75665 | Pm (6) | ✗ | 12 | 64 | 3 | 3.8179 | 4.380 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TiO2 | ICSD | 41493 | P3_121 (152) | ✗ | 9 | 72 | 3 | 3.8185 | 3.903 | 0.000 | (0;000) | ✗ | 06/10/16 |
| LiIO3 | ICSD | 35475 | P6_3 (173) | ✗ | 10 | 56 | 1 | 3.8193 | 3.892 | 0.000 | (0;000) | ✗ | 29/11/16 |
| Ba2ZnWO6 | ICSD | 24983 | Fm-3m (225) | ✔ | 10 | 82 | 3 | 3.82 | 3.896 | 0.000 | (0;000) | ✗ | 05/01/17 |
| CsI | ICSD | 61517 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 3.8212 | 3.821 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Si3N4 | COD | 1001249 | P6_3/m (176) | ✔ | 14 | 64 | 3 | 3.8214 | 4.349 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CsBrO4 | COD | 4031454 | I4_1/amd (141) | ✔ | 12 | 80 | 1 | 3.8217 | 3.822 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KZnF3 | COD | 5910077 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 3.8219 | 5.649 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiH3IN | ICSD | 55064 | P2_1 (4) | ✗ | 12 | 36 | 1 | 3.8239 | 3.825 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Cs2LiVO4 | ICSD | 40219 | Cmc2_1 (36) | ✗ | 16 | 116 | 1 | 3.8248 | 3.850 | 0.000 | (0;000) | ✗ | 22/03/17 |
| AlTl(MoO4)2 | ICSD | 250339 | P-3m1 (164) | ✔ | 12 | 92 | 2 | 3.8281 | 3.985 | 0.000 | (0;000) | ✗ | 05/01/17 |
| NaZnF3 | ICSD | 69349 | Pnma (62) | ✔ | 20 | 168 | 3 | 3.8293 | 3.829 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ZnCl2 | COD | 4343817 | Pna2_1 (33) | ✗ | 12 | 104 | 3 | 3.8314 | 3.832 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Ca2ScSbO6 | ICSD | 262995 | P2_1/c (14) | ✔ | 20 | 144 | 3 | 3.8324 | 4.021 | 0.000 | (0;000) | ✗ | 02/02/17 |