Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sr3(SiAs2)2 | COD | 1528461 | C2/c (15) | ✔ | 18 | 116 | 1 | 0.8782 | 0.878 | 0.000 | (0;000) | ✗ | 30/01/17 |
| TaCuO3 | ICSD | 164934 | R3c (161) | ✗ | 10 | 84 | 3 | 0.8785 | 0.879 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SnI4 | ICSD | 18010 | P-43m (215) | ✗ | 5 | 42 | 1 | 0.8791 | 0.882 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cd(InTe2)2 | ICSD | 620058 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.8795 | 0.880 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na2LiN | COD | 1526567 | P4/nmm (129) | ✔ | 8 | 52 | 1 | 0.8797 | 0.880 | 0.000 | (0;000) | ✗ | 27/01/17 |
| WS2 | ICSD | 202367 | R3m (160) | ✗ | 3 | 26 | 2 | 0.8802 | 1.635 | 0.000 | (0;000) | ✗ | 06/10/16 |
| H3I3N2 | ICSD | 27416 | P2_1/m (11) | ✔ | 16 | 68 | 3 | 0.8803 | 1.057 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CoAsS | ICSD | 31189 | P2_1ca (29) | ✗ | 12 | 80 | 3 | 0.8804 | 1.143 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MoS2 | ICSD | 644259 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.8813 | 1.652 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BaSbClO2 | ICSD | 200962 | Cmcm (63) | ✔ | 10 | 68 | 1 | 0.8819 | 2.937 | 1.000 | (0;000) | ✗ | 02/02/17 |
| In5Se5Cl | ICSD | 414220 | P2_1/m (11) | ✔ | 22 | 204 | 3 | 0.8819 | 0.937 | 0.000 | (0;000) | ✗ | 07/08/17 |
| HgO2 | ICSD | 655816 | C2/m (12) | ✔ | 3 | 24 | 3 | 0.8821 | 1.430 | 0.000 | (0;000) | ✗ | 27/01/17 |
| HgO2 | ICSD | 48214 | C2/m (12) | ✔ | 3 | 24 | 3 | 0.8828 | 1.430 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na2PtSe2 | ICSD | 40429 | Cmc2_1 (36) | ✗ | 10 | 80 | 1 | 0.8836 | 1.266 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CO2 | ICSD | 188893 | Cmce (64) | ✔ | 6 | 32 | 1 | 0.8836 | 1.332 | 0.000 | (0;000) | ✗ | 27/01/17 |
| RbBa4Sb3O | ICSD | 415036 | I4/mcm (140) | ✔ | 18 | 140 | 1 | 0.8848 | 0.993 | 0.000 | (0;000) | ✗ | 02/02/17 |
| VAg3O4 | COD | 4001677 | C2/c (15) | ✔ | 16 | 140 | 3 | 0.8865 | 1.160 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Cs6InAs3 | ICSD | 300145 | P2_1/m (11) | ✔ | 20 | 164 | 3 | 0.8866 | 0.887 | 0.000 | (0;000) | ✗ | 21/03/17 |
| CuSe3Br | COD | 1524480 | Pmna (53) | ✔ | 20 | 144 | 3 | 0.8867 | 1.006 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ba(CuS)2 | COD | 1521193 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.8873 | 0.887 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cd(InSe2)2 | ICSD | 151954 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.8879 | 0.888 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K4BeAs2 | ICSD | 300111 | R-3m (166) | ✔ | 7 | 50 | 1 | 0.8884 | 0.888 | 0.000 | (0;000) | ✗ | 30/01/17 |
| K2NaGaAs2 | ICSD | 300129 | Ibam (72) | ✔ | 12 | 100 | 1 | 0.8897 | 0.890 | 0.000 | (0;000) | ✗ | 30/01/17 |
| K4CdP2 | ICSD | 61084 | R-3m (166) | ✔ | 7 | 58 | 1 | 0.89 | 0.963 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb7NbAs4 | ICSD | 380111 | Pmn2_1 (31) | ✗ | 24 | 192 | 1 | 0.8901 | 0.979 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Al4C3 | ICSD | 14397 | R3m (160) | ✗ | 7 | 24 | 3 | 0.8906 | 1.617 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BaS3 | COD | 1010269 | P2_12_12 (18) | ✗ | 16 | 112 | 3 | 0.8913 | 0.979 | 0.000 | (0;000) | ✗ | 21/03/17 |
| BaCdAsF | ICSD | 189938 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.8914 | 0.891 | 0.000 | (0;000) | ✗ | 05/01/17 |
| LiBeAs | COD | 7221252 | P4/nmm (129) | ✔ | 6 | 24 | 1 | 0.8927 | 1.201 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Rb2Te2Pt | ICSD | 649525 | Immm (71) | ✔ | 5 | 40 | 1 | 0.8933 | 1.288 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K2PdSe2 | ICSD | 641298 | Immm (71) | ✔ | 5 | 48 | 1 | 0.8935 | 1.406 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TlPAuSe3 | COD | 4000517 | C2/m (12) | ✔ | 12 | 94 | 1 | 0.8936 | 1.034 | 0.000 | (0;000) | ✗ | 02/02/17 |
| GeS | ICSD | 637785 | Pmnb (62) | ✔ | 8 | 40 | 2 | 0.8942 | 1.214 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ba2VN3 | ICSD | 80177 | Cmce (64) | ✔ | 24 | 192 | 2 | 0.8948 | 0.895 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SrPbO3 | COD | 2002889 | Pnma (62) | ✔ | 20 | 168 | 3 | 0.8952 | 0.895 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SrZnPF | COD | 7203808 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.8953 | 0.895 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K3NaFeCl6 | ICSD | 23182 | R-3m (166) | ✔ | 11 | 86 | 1 | 0.8954 | 0.895 | 0.000 | (0;000) | ✗ | 02/02/17 |
| HgI2 | COD | 9014434 | P4_2/nmc (137) | ✔ | 6 | 52 | 2 | 0.8955 | 0.896 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sr5(AuO4)2 | COD | 2002552 | F222 (22) | ✗ | 15 | 120 | 3 | 0.8956 | 0.898 | 0.000 | (0;000) | ✗ | 21/03/17 |
| NaH2N | ICSD | 14007 | Fddd (70) | ✔ | 16 | 64 | 1 | 0.8969 | 0.913 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NaSbS2 | COD | 1530128 | P-1 (2) | ✔ | 8 | 52 | 1 | 0.898 | 0.898 | 0.000 | (0;000) | ✗ | 27/01/17 |
| RhF3 | COD | 2310599 | R-3c (167) | ✔ | 8 | 76 | 3 | 0.8988 | 1.057 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Sc2CdS4 | ICSD | 94994 | Fd-3m (227) | ✔ | 14 | 116 | 3 | 0.8989 | 0.899 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BiSeI | COD | 2010577 | Pnma (62) | ✔ | 12 | 112 | 1 | 0.8997 | 0.935 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Hg2As3Br | ICSD | 75169 | C2/c (15) | ✔ | 12 | 92 | 3 | 0.9002 | 1.173 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Tl2PAuS4 | ICSD | 85680 | P2_1/m (11) | ✔ | 16 | 132 | 2 | 0.9005 | 0.970 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Pb5(IF4)2 | ICSD | 36334 | R3m (160) | ✗ | 15 | 140 | 1 | 0.903 | 1.450 | 0.000 | (0;000) | ✗ | 11/04/17 |
| HfTlCuS3 | ICSD | 82562 | Cmcm (63) | ✔ | 12 | 108 | 3 | 0.9041 | 0.911 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaBrO3 | COD | 1010058 | P2_13 (198) | ✗ | 20 | 136 | 1 | 0.9042 | 0.932 | 0.000 | (0;000) | ✗ | 21/03/17 |
| ZnO | ICSD | 190807 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.9046 | 2.298 | 0.000 | (0;000) | ✗ | 27/01/17 |