Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▴ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| KBrF4 | COD | 1524295 | I4/mcm (140) | ✔ | 12 | 88 | 1 | 3.5441 | 3.575 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb2LiGaF6 | ICSD | 50468 | R-3m (166) | ✔ | 20 | 152 | 1 | 6.4902 | 6.490 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TiAs2O7 | COD | 4030527 | C2/c (15) | ✔ | 20 | 128 | 3 | 2.933 | 3.166 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Mg3Nb6O11 | COD | 1530351 | P-3m1 (164) | ✔ | 20 | 174 | 3 | 0.1754 | 0.735 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CaCO3 | ICSD | 186772 | P-1 (2) | ✔ | 20 | 128 | 1 | 3.6119 | 3.614 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ca3WO6 | ICSD | 262323 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 3.2315 | 3.447 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CaCO3 | COD | 9016547 | Pnma (62) | ✔ | 20 | 128 | 1 | 4.3434 | 4.687 | 0.000 | (0;000) | ✗ | 02/02/17 |
| PbIBr | ICSD | 22138 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.7861 | 1.908 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SrSiN2 | COD | 4343851 | P2_1/c (14) | ✔ | 16 | 96 | 1 | 2.9169 | 3.060 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CsCa2Ta3O10 | ICSD | 89011 | P4/mmm (123) | ✔ | 16 | 128 | 2 | 2.3868 | 2.700 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ba2Pb | ICSD | 416561 | Pnma (62) | ✔ | 12 | 136 | 1 | 0.0261 | 0.029 | 0.000 | (1;000) | ✗ | 02/02/17 |
| SiH3I | ICSD | 65044 | P2_1/c (14) | ✔ | 20 | 56 | 1 | 3.9747 | 4.155 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CsS3 | ICSD | 24678 | P-1 (2) | ✔ | 16 | 108 | 1 | 1.511 | 1.621 | 0.000 | (0;000) | ✗ | 02/02/17 |
| H4INO4 | COD | 2008618 | I4_1/a (88) | ✔ | 20 | 80 | 1 | 2.8578 | 2.859 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CrAg3ClO4 | COD | 8100983 | P4/nmm (129) | ✔ | 18 | 156 | 3 | 1.3301 | 1.661 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Rb3CO3F | ICSD | 66029 | R-3c (167) | ✔ | 16 | 112 | 1 | 3.5487 | 3.549 | 0.000 | (0;000) | ✗ | 02/02/17 |
| HPbBrO | ICSD | 404573 | Pnma (62) | ✔ | 16 | 112 | 3 | 2.8066 | 2.835 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SiC(ClF)3 | ICSD | 173735 | C2/m (12) | ✔ | 16 | 100 | 1 | 6.2495 | 6.314 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K2Mo(SO)2 | ICSD | 423986 | C2/c (15) | ✔ | 14 | 112 | 1 | 2.0758 | 2.280 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb2As2Pt | ICSD | 107529 | Cmcm (63) | ✔ | 10 | 76 | 1 | 0.364 | 0.394 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Ba3MgNb2O9 | ICSD | 95406 | P-3m1 (164) | ✔ | 15 | 120 | 3 | 2.0458 | 2.122 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Tl2TeI6 | ICSD | 99128 | P2_1/c (14) | ✔ | 18 | 148 | 3 | 1.2944 | 1.353 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Na5Zr2F13 | COD | 2310402 | C2/m (12) | ✔ | 20 | 144 | 2 | 4.616 | 4.616 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BaNb2O6 | ICSD | 28253 | Pmma (51) | ✔ | 18 | 144 | 3 | 1.3837 | 1.410 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaSr2IO6 | ICSD | 425447 | P2_1/c (14) | ✔ | 20 | 144 | 3 | 2.1609 | 2.225 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SnS | COD | 9008295 | Cmcm (63) | ✔ | 4 | 40 | 3 | 0.5955 | 0.596 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K4BeAs2 | ICSD | 300111 | R-3m (166) | ✔ | 7 | 50 | 1 | 0.8884 | 0.888 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Cs2AgSbS4 | ICSD | 55367 | P-1 (2) | ✔ | 16 | 116 | 1 | 1.6561 | 1.709 | 0.000 | (0;000) | ✗ | 30/01/17 |
| ZnAs | COD | 4340531 | Pbca (61) | ✔ | 16 | 136 | 3 | 0.3354 | 0.637 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Ca2Si | ICSD | 191034 | Pnma (62) | ✔ | 12 | 96 | 1 | 0.3204 | 0.320 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CaSnO3 | COD | 9015651 | Pnma (62) | ✔ | 20 | 168 | 3 | 2.7125 | 2.829 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Li8TeN2 | ICSD | 247257 | I4_1md (109) | ✗ | 22 | 80 | 1 | 2.2789 | 2.280 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Na2MgSiO4 | ICSD | 15619 | Pc (7) | ✗ | 16 | 112 | 3 | 3.9447 | 4.042 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na3MoNO3 | ICSD | 98673 | Pmn2_1 (31) | ✗ | 16 | 128 | 1 | 3.4025 | 3.551 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ZnTeMoO6 | ICSD | 250523 | P2_12_12 (18) | ✗ | 18 | 136 | 2 | 3.0362 | 3.097 | 0.000 | (0;000) | ✗ | 29/03/17 |
| N2O3 | ICSD | 80890 | P2_12_12_1 (19) | ✗ | 20 | 112 | 1 | 1.128 | 1.175 | 0.000 | (0;000) | ✗ | 29/03/17 |
| S3N2O | COD | 7005890 | Cc (9) | ✗ | 12 | 68 | 1 | 2.1634 | 2.250 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Pb(SN)2 | ICSD | 49539 | P2_12_12_1 (19) | ✗ | 20 | 144 | 1 | 1.3435 | 1.403 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4ReN3 | ICSD | 411243 | Cc (9) | ✗ | 16 | 132 | 1 | 2.236 | 2.312 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na2ZnSiO4 | COD | 1009030 | Pc (7) | ✗ | 16 | 116 | 3 | 3.1876 | 3.392 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na3VSO3 | ICSD | 419401 | R3c (161) | ✗ | 16 | 128 | 1 | 2.9992 | 2.999 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na3PS3O | ICSD | 98651 | Cmc2_1 (36) | ✗ | 16 | 112 | 1 | 2.9751 | 2.975 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na3VS3O | COD | 2203124 | Cmc2_1 (36) | ✗ | 16 | 128 | 1 | 1.9108 | 1.947 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na3PS4 | ICSD | 72860 | P-42_1c (114) | ✗ | 16 | 112 | 1 | 2.3398 | 2.340 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4SnO3 | ICSD | 49624 | Cc (9) | ✗ | 16 | 136 | 1 | 1.9151 | 2.076 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4Sr(SiO3)3 | ICSD | 33943 | C2 (5) | ✗ | 17 | 112 | 1 | 4.2957 | 4.296 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4SnS4 | ICSD | 42035 | P-42_1c (114) | ✗ | 18 | 148 | 1 | 2.2298 | 2.230 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4SnSe4 | ICSD | 72384 | P-42_1c (114) | ✗ | 18 | 148 | 1 | 1.5747 | 1.575 | 0.000 | (0;000) | ✗ | 29/03/17 |
| NaNbO3 | COD | 1528864 | Pmc2_1 (26) | ✗ | 20 | 160 | 3 | 2.3551 | 2.359 | 0.000 | (0;000) | ✗ | 29/03/17 |
| NaSb(PS3)2 | ICSD | 155270 | P2_1 (4) | ✗ | 20 | 120 | 2 | 1.9131 | 2.022 | 0.000 | (0;000) | ✗ | 29/03/17 |