Plotting...
| ▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| LiMnO2 | COD | 1513963 | I4_1/amd (141) | ✔ | 16 | 120 | 3 | 0.0 | 0.001 | 0.726 | (1;111) | ✗ | 29/03/17 |
| LiMnO4 | COD | 1514003 | Cmcm (63) | ✔ | 12 | 84 | 1 | 1.4727 | 1.507 | 0.000 | (0;000) | ✗ | 04/08/17 |
| LiMnO2 | COD | 1514015 | Pmmn (59) | ✔ | 8 | 60 | 1 | 0.0 | 0.002 | 0.207 | (1;000) | ✗ | 27/01/17 |
| Li2MnO3 | COD | 1514066 | C2/m (12) | ✔ | 12 | 78 | 2 | 0.053 | 0.078 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Li2O2 | COD | 1514083 | P6_3/mmc (194) | ✔ | 8 | 36 | 2 | 2.7158 | 2.716 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Li2O2 | COD | 1514085 | P6_3/mmc (194) | ✔ | 8 | 36 | 3 | 0.0 | 0.017 | 0.358 | (1;000) | ✗ | 27/01/17 |
| Li2O2 | COD | 1514089 | P6_3/mmc (194) | ✔ | 8 | 36 | 1 | 1.6247 | 1.625 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiO2 | COD | 1514090 | Pnnm (58) | ✔ | 6 | 30 | 1 | 0.0 | 0.000 | 0.990 | (0;110) | ✗ | 27/01/17 |
| Li2O | COD | 1514092 | Fm-3m (225) | ✔ | 3 | 12 | 1 | 4.981 | 5.252 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Li2TiO3 | COD | 1515995 | C2/c (15) | ✔ | 24 | 144 | 2 | 3.2446 | 3.440 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CrO2 | COD | 1516110 | P4_2/mnm (136) | ✔ | 6 | 52 | 3 | 0.0 | 0.001 | 0.616 | (0;000) | ✗ | 27/01/17 |
| NbPO5 | COD | 1517726 | P4/nmm (129) | ✔ | 14 | 96 | 3 | 3.3846 | 3.666 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Sr2TiO4 | COD | 1517788 | I4/mmm (139) | ✔ | 7 | 56 | 2 | 2.2547 | 2.423 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CO2 | COD | 1517803 | P4_2/mnm (136) | ✔ | 6 | 32 | 1 | 5.8825 | 6.623 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K3FeO2 | COD | 1517825 | P4_12_12 (92) | ✗ | 24 | 188 | 2 | 0.0 | 0.000 | 0.445 | ? | ✗ | 04/08/17 |
| K3NiO2 | COD | 1517826 | P4_12_12 (92) | ✗ | 24 | 196 | 3 | 0.0 | 0.000 | 0.581 | ? | ✗ | 04/08/17 |
| CsAu | COD | 1517937 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 1.0321 | 1.117 | 0.000 | (0;000) | ✗ | 05/01/17 |
| RbAu | COD | 1517938 | Pm-3m (221) | ✔ | 2 | 20 | 1 | 0.1979 | 1.158 | 0.000 | (0;000) | ✗ | 05/01/17 |
| BaAl4S7 | COD | 1518017 | Pmn2_1 (31) | ✗ | 24 | 128 | 3 | 3.0756 | 3.286 | 0.000 | (0;000) | ✗ | 04/08/17 |
| BaGa4S7 | COD | 1518018 | Pmn2_1 (31) | ✗ | 24 | 208 | 3 | 2.4589 | 2.461 | 0.000 | (0;000) | ✗ | 04/08/17 |
| GaAsO4 | COD | 1518032 | P3_121 (152) | ✗ | 18 | 126 | 3 | 3.387 | 3.502 | 0.000 | (0;000) | ✗ | 21/03/17 |
| GaPO4 | COD | 1518035 | P3_121 (152) | ✗ | 18 | 126 | 3 | 4.8416 | 4.939 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Ba3(GaS3)2 | COD | 1518040 | C2/c (15) | ✔ | 22 | 184 | 1 | 2.6437 | 2.644 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Sr2Pb3 | COD | 1518043 | P4/mbm (127) | ✔ | 10 | 124 | 2 | 0.0 | 0.043 | 0.538 | (0;000) | ✗ | 02/02/17 |
| Y(SiIr)2 | COD | 1518050 | P4/nmm (129) | ✔ | 10 | 106 | 3 | 0.0 | 0.000 | 0.926 | (0;000) | ✗ | 27/01/17 |
| K3Al2As3 | COD | 1518076 | P2_1/m (11) | ✔ | 16 | 96 | 1 | 1.3297 | 1.330 | 0.000 | (0;000) | ✗ | 30/01/17 |
| CaMnF5 | COD | 1518174 | C2/c (15) | ✔ | 14 | 120 | 1 | 0.0 | 0.002 | 0.361 | (0;000) | ✗ | 04/08/17 |
| Cs2CdI4 | COD | 1518204 | P2_1/m (11) | ✔ | 14 | 116 | 1 | 2.7112 | 2.711 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KO3 | COD | 1518207 | I4/mcm (140) | ✔ | 16 | 108 | 1 | 0.0 | 0.000 | 0.588 | (0;000) | ✗ | 02/02/17 |
| MnNb3O6 | COD | 1519036 | Immm (71) | ✔ | 20 | 180 | 3 | 0.0 | 0.007 | 0.314 | (0;000) | ✗ | 29/03/17 |
| Pb7(BrF6)2 | COD | 1519065 | P-6 (174) | ✗ | 21 | 196 | 3 | 3.5865 | 3.621 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ni7Bi3 | COD | 1519106 | Pmma (51) | ✔ | 20 | 230 | 1 | 0.0 | 0.000 | 0.438 | (0;001) | ✗ | 02/02/17 |
| GaBO3 | COD | 1520321 | R-3c (167) | ✔ | 10 | 68 | 3 | 4.3438 | 4.344 | 0.000 | (0;000) | ✗ | 05/01/17 |
| TiS3 | COD | 1520546 | P2_1/m (11) | ✔ | 8 | 60 | 2 | 0.2822 | 0.309 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Cs3Sb2I9 | COD | 1520793 | P-3m1 (164) | ✔ | 14 | 100 | 2 | 1.2671 | 1.279 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TlF | COD | 1520823 | Pbcm (57) | ✔ | 8 | 80 | 2 | 2.8245 | 2.913 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TlF | COD | 1520825 | P4/nmm (129) | ✔ | 4 | 40 | 1 | 2.7739 | 2.809 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ti3SiC2 | COD | 1520829 | P6_3/mmc (194) | ✔ | 12 | 96 | 3 | 0.0 | 0.013 | 0.484 | (1;000) | ✗ | 27/01/17 |
| Rb2Te3 | COD | 1520875 | Pnma (62) | ✔ | 20 | 144 | 1 | 0.6435 | 0.755 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CuGeO3 | COD | 1520902 | Pmma (51) | ✔ | 10 | 66 | 3 | 0.0 | 0.000 | 0.935 | (0;100) | ✗ | 27/01/17 |
| MgSiN2 | COD | 1520911 | Pna2_1 (33) | ✗ | 16 | 96 | 3 | 4.1594 | 4.589 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Sr2Si | COD | 1520913 | Pnma (62) | ✔ | 12 | 96 | 1 | 0.3629 | 0.363 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sr2Ge | COD | 1520914 | Pnma (62) | ✔ | 12 | 96 | 1 | 0.3586 | 0.359 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TeO2 | COD | 1520934 | P2_12_12_1 (19) | ✗ | 12 | 72 | 3 | 3.0222 | 3.190 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Sr(Cu2As)2 | COD | 1521016 | R-3m (166) | ✔ | 7 | 64 | 2 | 0.0 | 0.011 | 0.421 | (1;000) | ✗ | 05/01/17 |
| Ba(Cu2As)2 | COD | 1521018 | R-3m (166) | ✔ | 7 | 64 | 2 | 0.0 | 0.006 | 0.401 | (1;000) | ✗ | 05/01/17 |
| Ba2In2O5 | COD | 1521023 | Ima2 (46) | ✗ | 18 | 152 | 3 | 1.0151 | 1.015 | 0.000 | (0;000) | ✗ | 21/03/17 |
| Ba2PdF6 | COD | 1521027 | Cmce (64) | ✔ | 18 | 160 | 1 | 1.8177 | 1.818 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ca(SiNi)2 | COD | 1521052 | I4/mmm (139) | ✔ | 5 | 38 | 3 | 0.0 | 0.011 | 0.695 | (0;111) | ✗ | 27/01/17 |
| TeOF2 | COD | 1521091 | P2_1 (4) | ✗ | 16 | 104 | 3 | 3.8393 | 3.841 | 0.000 | (0;000) | ✗ | 22/03/17 |