▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ca4TiN4 | COD | 1528590 | P-1 (2) | ✔ | 18 | 144 | 1 | 1.5561 | 1.680 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca(ClO2)2 | COD | 2207379 | Ccce (68) | ✔ | 14 | 96 | 1 | 2.1995 | 2.281 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca5Sb3 | COD | 4002403 | P6_3/mcm (193) | ✔ | 16 | 130 | 1 | 0.0 | 0.000 | 0.542 | (1;000) | ✗ | 02/02/17 |
Ca(ClO)2 | COD | 9008001 | Ccce (68) | ✔ | 20 | 144 | 1 | 0.0 | 0.021 | 0.172 | (1;000) | ✗ | 02/02/17 |
Sr(Cd2Pt)2 | COD | 4334059 | P4_2/mnm (136) | ✔ | 14 | 156 | 3 | 0.0 | 0.021 | 0.964 | (1;000) | ✗ | 02/02/17 |
CaTcO3 | COD | 4105648 | Pnma (62) | ✔ | 20 | 172 | 0 | 0.0 | 0.000 | 0.313 | (0;110) | ✗ | 02/02/17 |
Li2Ca | COD | 1527864 | P6_3/mmc (194) | ✔ | 12 | 64 | 1 | 0.0 | 0.001 | 0.548 | (1;000) | ✗ | 02/02/17 |
CaGeO3 | COD | 9000904 | Pnma (62) | ✔ | 20 | 128 | 3 | 2.1712 | 2.229 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaFe(SiO3)2 | COD | 9001813 | C2/c (15) | ✔ | 20 | 124 | 3 | 0.742 | 0.746 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaZn(GeO3)2 | COD | 2014615 | C2/c (15) | ✔ | 20 | 132 | 3 | 2.8081 | 2.912 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaInPt | COD | 1527282 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.000 | 0.828 | (0;011) | ✗ | 02/02/17 |
AgCSN | COD | 8100412 | C2/c (15) | ✔ | 16 | 104 | 3 | 2.0827 | 2.362 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaIn4Ni | COD | 1528112 | Cmcm (63) | ✔ | 12 | 144 | 3 | 0.0 | 0.004 | 0.793 | (1;110) | ✗ | 02/02/17 |
CaSnO3 | COD | 9015651 | Pnma (62) | ✔ | 20 | 168 | 3 | 2.7125 | 2.829 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaMg(SiO3)2 | COD | 9000506 | C2/c (15) | ✔ | 20 | 128 | 3 | 3.7875 | 3.788 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaMg2 | COD | 4313238 | P6_3/mmc (194) | ✔ | 12 | 120 | 1 | 0.0 | 0.001 | 0.548 | (1;000) | ✗ | 02/02/17 |
CaMg(SiO3)2 | COD | 9000335 | C2/c (15) | ✔ | 20 | 128 | 3 | 5.073 | 5.073 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaSi2NiO6 | COD | 9001303 | C2/c (15) | ✔ | 20 | 128 | 3 | 0.0 | 0.007 | 0.582 | (1;000) | ✗ | 02/02/17 |
CaMgSi | COD | 4000954 | Pnma (62) | ✔ | 12 | 96 | 3 | 0.0 | 0.012 | 0.072 | (0;000) | ✗ | 02/02/17 |
CaMoO3 | COD | 1528660 | Pnma (62) | ✔ | 20 | 168 | 3 | 0.0 | 0.016 | 0.488 | (0;000) | ✗ | 02/02/17 |
Sr5Cd3 | COD | 1527309 | I4/mcm (140) | ✔ | 16 | 172 | 1 | 0.0 | 0.006 | 0.538 | (0;111) | ✗ | 02/02/17 |
BaCO3 | COD | 1011149 | Pnma (62) | ✔ | 20 | 128 | 2 | 4.4216 | 4.463 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr2CaWO6 | COD | 2104688 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 3.3236 | 3.434 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaVO3 | COD | 4336390 | Pnma (62) | ✔ | 20 | 164 | 3 | 0.0 | 0.001 | 0.649 | (0;110) | ✗ | 02/02/17 |
CaSO6 | COD | 9015350 | C2/c (15) | ✔ | 16 | 104 | 1 | 0.0 | 0.006 | 0.453 | (0;000) | ✗ | 02/02/17 |
BaZnCO3F2 | COD | 1100122 | P6_3/m (176) | ✔ | 16 | 116 | 2 | 5.0322 | 5.038 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrCaSi | COD | 1528697 | Pnma (62) | ✔ | 12 | 96 | 1 | 0.4161 | 0.434 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaMnCO3F2 | COD | 1100121 | P6_3/m (176) | ✔ | 16 | 122 | 2 | 0.0 | 0.000 | 0.877 | (0;000) | ✗ | 02/02/17 |
Cd3P2 | COD | 1010127 | Pn-3m (224) | ✔ | 10 | 92 | 3 | 0.0 | 0.005 | 0.246 | (1;000) | ✗ | 02/02/17 |
CaCO3 | COD | 9016600 | Pnma (62) | ✔ | 20 | 128 | 1 | 3.8664 | 3.866 | 0.000 | (0;000) | ✗ | 02/02/17 |
CBrF2 | COD | 7200672 | P2_1/c (14) | ✔ | 16 | 100 | 1 | 4.3722 | 4.447 | 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 |
Cd3PCl3 | COD | 1001626 | P-3 (147) | ✔ | 14 | 124 | 3 | 2.0234 | 2.170 | 0.000 | (0;000) | ✗ | 02/02/17 |
CSCl2O | COD | 7050458 | P2_1/c (14) | ✔ | 20 | 120 | 1 | 3.0161 | 3.088 | 0.000 | (0;000) | ✗ | 02/02/17 |
Zr3Cd2 | COD | 2106134 | Pmmm (47) | ✔ | 5 | 36 | 2 | 0.0 | 0.003 | 0.647 | (1;001) | ✗ | 02/02/17 |
Cs2SnI6 | COD | 4335642 | Fm-3m (225) | ✔ | 9 | 74 | 2 | 0.0894 | 0.089 | 0.000 | (0;000) | ✗ | 02/02/17 |
Tl3FeCl5 | COD | 1523978 | I4/mcm (140) | ✔ | 18 | 164 | 1 | 0.0 | 0.001 | 0.349 | (1;001) | ✗ | 02/02/17 |
PbCl2 | COD | 9009195 | Pnma (62) | ✔ | 12 | 112 | 3 | 3.2349 | 3.329 | 0.000 | (0;000) | ✗ | 02/02/17 |
HCCl3 | COD | 7211802 | Pnma (62) | ✔ | 20 | 104 | 1 | 4.814 | 4.817 | 0.000 | (0;000) | ✗ | 02/02/17 |
VCdO3 | COD | 1528346 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.000 | 0.658 | (0;110) | ✗ | 02/02/17 |
KCdF3 | COD | 1530090 | Pnma (62) | ✔ | 20 | 168 | 3 | 3.3039 | 3.304 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cr2CdSe4 | COD | 9012053 | Fd-3m (227) | ✔ | 14 | 128 | 3 | 0.0 | 0.007 | 0.094 | (0;000) | ✗ | 02/02/17 |
CsYCdSe3 | COD | 4313788 | Cmcm (63) | ✔ | 12 | 100 | 1 | 2.1463 | 2.153 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSeO3 | COD | 2009816 | Pnma (62) | ✔ | 20 | 144 | 3 | 3.3067 | 3.472 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdGeO3 | COD | 9005881 | Pnma (62) | ✔ | 20 | 136 | 3 | 1.2811 | 1.281 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na2CdSn | COD | 7221227 | P6_3/mmc (194) | ✔ | 8 | 88 | 1 | 0.0 | 0.037 | 0.109 | (0;000) | ✗ | 02/02/17 |
HCCl2 | COD | 7106717 | P2_1/c (14) | ✔ | 16 | 76 | 1 | 5.0857 | 5.162 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrCdPt | COD | 2240266 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.047 | 0.554 | (1;000) | ✗ | 02/02/17 |
CdSe2O5 | COD | 2010004 | C2/c (15) | ✔ | 16 | 108 | 3 | 3.2062 | 3.475 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd | COD | 4030924 | P-1 (2) | ✔ | 1 | 12 | 1 | 4.3147 | 4.315 | 0.000 | (0;000) | ✗ | 02/02/17 |