▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TePIr | ICSD | 601289 | Pbca (61) | ✔ | 24 | 224 | 2 | 0.7269 | 0.998 | 0.000 | (0;000) | ✗ | 04/08/17 |
In2Te5 | ICSD | 640615 | Cc (9) | ✗ | 14 | 112 | 2 | 0.8149 | 0.931 | 0.000 | (0;000) | ✗ | 29/03/17 |
Cs2LiCo(CN)6 | ICSD | 23204 | Fm-3m (225) | ✔ | 16 | 92 | 2 | 4.0485 | 4.056 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbC8 | ICSD | 200563 | Fddd (70) | ✔ | 18 | 82 | 2 | 0.0 | 0.000 | 0.817 | (1;111) | ✗ | 02/02/17 |
CuI | COD | 9013923 | P4/nmm (129) | ✔ | 4 | 36 | 2 | 1.3057 | 1.306 | 0.000 | (0;000) | ✗ | 22/03/17 |
Ca2Zn2CuP3 | ICSD | 89517 | P6_3/mmc (194) | ✔ | 16 | 140 | 2 | 0.2555 | 0.326 | 0.000 | (0;000) | ✗ | 02/02/17 |
PdCl2 | ICSD | 404624 | R-3 (148) | ✔ | 18 | 192 | 2 | 1.2092 | 1.289 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsZn4P3 | ICSD | 262031 | P4/mmm (123) | ✔ | 8 | 72 | 2 | 0.0592 | 0.059 | 0.000 | (0;000) | ✗ | 07/04/17 |
WCl3O | ICSD | 416393 | P4_2/mnm (136) | ✔ | 20 | 220 | 2 | 0.0992 | 0.099 | 0.000 | (0;000) | ✗ | 11/04/17 |
RbPbIO6 | ICSD | 73615 | P6_322 (182) | ✗ | 18 | 132 | 2 | 0.0 | 0.000 | 0.244 | (1;000) | ✔ | 11/04/17 |
WS2 | COD | 9009145 | P6_3/mmc (194) | ✔ | 6 | 80 | 2 | 0.9842 | 1.553 | 0.000 | (0;000) | ✗ | 11/04/17 |
Ca2NiWO6 | ICSD | 155734 | P2_1/c (14) | ✔ | 20 | 160 | 2 | 0.0 | 0.135 | 0.107 | (0;000) | ✗ | 02/02/17 |
Ba3In2Cl2O5 | COD | 2002522 | I4/mmm (139) | ✔ | 12 | 100 | 2 | 1.6797 | 2.375 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca3(GaN2)2 | COD | 4323350 | C2/c (15) | ✔ | 18 | 152 | 2 | 1.9889 | 1.989 | 0.000 | (0;000) | ✗ | 02/02/17 |
SnO | COD | 1101035 | Cmc2_1 (36) | ✗ | 8 | 80 | 2 | 0.0 | 0.009 | 0.349 | (1;011) | ✔ | 15/02/17 |
Li2RuO3 | ICSD | 202611 | C2/m (12) | ✔ | 12 | 80 | 2 | 0.0 | 0.087 | 0.084 | (0;001) | ✗ | 04/08/17 |
Ca3Pd2 | ICSD | 619502 | R-3 (148) | ✔ | 15 | 198 | 2 | 0.0 | 0.025 | 0.742 | (0;000) | ✗ | 02/02/17 |
NbF5 | ICSD | 26647 | C2/m (12) | ✔ | 24 | 192 | 2 | 5.6485 | 5.679 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ca5Hg3 | COD | 1527308 | I4/mcm (140) | ✔ | 16 | 172 | 2 | 0.0 | 0.019 | 0.388 | (0;111) | ✗ | 21/03/17 |
Ca5Pd2 | ICSD | 619503 | C2/c (15) | ✔ | 14 | 172 | 2 | 0.0 | 0.016 | 0.327 | (0;000) | ✗ | 02/02/17 |
MnTeMoO6 | ICSD | 163980 | P2_12_12 (18) | ✗ | 18 | 142 | 2 | 0.0 | 0.000 | 0.671 | ? | ✗ | 29/03/17 |
H3C2O | COD | 2216740 | P-1 (2) | ✔ | 24 | 68 | 2 | 3.2998 | 3.326 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiSbS2 | ICSD | 40457 | R-3 (148) | ✔ | 24 | 120 | 2 | 1.167 | 1.543 | 0.000 | (0;000) | ✗ | 04/08/17 |
Fe(CO)5 | COD | 2310564 | C2/c (15) | ✔ | 22 | 116 | 2 | 3.6826 | 3.720 | 0.000 | (0;000) | ✗ | 04/08/17 |
ZnTeMoO6 | ICSD | 250523 | P2_12_12 (18) | ✗ | 18 | 136 | 2 | 3.0362 | 3.097 | 0.000 | (0;000) | ✗ | 29/03/17 |
LiCaGaF6 | ICSD | 152300 | P-31c (163) | ✔ | 18 | 136 | 2 | 5.5593 | 5.621 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Ti(AgS2)2 | COD | 4319682 | P4_2/mcm (132) | ✔ | 18 | 152 | 2 | 1.5463 | 1.851 | 0.000 | (0;000) | ✗ | 16/03/17 |
TiCl3 | ICSD | 26070 | P3_112 (151) | ✗ | 24 | 198 | 2 | 0.0 | 0.000 | 0.883 | ? | ✗ | 04/08/17 |
TcO3F | COD | 4339756 | P2_1/c (14) | ✔ | 20 | 160 | 2 | 5.8584 | 0.037 | 1.000 | (0;000) | ✗ | 02/02/17 |
CuClF10 | ICSD | 35387 | P2_1/c (14) | ✔ | 24 | 176 | 2 | 0.0 | 0.001 | 0.267 | (1;001) | ✗ | 04/08/17 |
AgCS(OF)3 | ICSD | 183643 | R-3 (148) | ✔ | 18 | 120 | 2 | 2.8132 | 3.334 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrRuO3 | ICSD | 82977 | Pnma (62) | ✔ | 20 | 176 | 2 | 0.0 | 0.020 | 0.552 | (0;000) | ✗ | 02/02/17 |
Cs2Zr(AgTe2)2 | ICSD | 80195 | C222 (21) | ✗ | 9 | 68 | 2 | 1.2649 | 1.606 | 0.000 | (0;000) | ✗ | 16/03/17 |
NaFeF4 | COD | 1527271 | P2_1/c (14) | ✔ | 24 | 180 | 2 | 0.0 | 0.003 | 0.391 | (0;000) | ✗ | 04/08/17 |
CaV2O5 | ICSD | 82689 | Pmmn (59) | ✔ | 16 | 132 | 2 | 0.0 | 0.028 | 0.223 | (0;000) | ✗ | 02/02/17 |
Li2TiGeO5 | ICSD | 250297 | P4/nmm (129) | ✔ | 18 | 104 | 2 | 3.6252 | 3.899 | 0.000 | (0;000) | ✗ | 04/08/17 |
HgPO4 | COD | 9008252 | P2_1/c (14) | ✔ | 24 | 164 | 2 | 0.0 | 0.006 | 0.481 | (1;000) | ✗ | 04/08/17 |
NbTe4Ir | ICSD | 656451 | Pmn2_1 (31) | ✗ | 24 | 216 | 2 | 0.0 | 0.002 | 0.162 | ? | ✗ | 04/08/17 |
K2SnO3 | ICSD | 24131 | Pnma (62) | ✔ | 24 | 200 | 2 | 1.6375 | 1.638 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li2TiSiO5 | ICSD | 87596 | P4/nmm (129) | ✔ | 18 | 104 | 2 | 3.363 | 3.614 | 0.000 | (0;000) | ✗ | 04/08/17 |
Mg5Ga2 | COD | 1522852 | Ibam (72) | ✔ | 14 | 152 | 2 | 0.0 | 0.003 | 0.465 | (1;111) | ✗ | 02/02/17 |
NbNiTe2 | ICSD | 71841 | Pma2 (28) | ✗ | 16 | 140 | 2 | 0.0 | 0.003 | 0.197 | ? | ✗ | 04/08/17 |
NbTe4Os | ICSD | 656450 | Pmn2_1 (31) | ✗ | 24 | 212 | 2 | 0.0 | 0.000 | 0.826 | ? | ✗ | 04/08/17 |
PbSO4 | ICSD | 100625 | Pnma (62) | ✔ | 24 | 176 | 2 | 0.0 | 0.004 | 0.527 | (0;000) | ✗ | 04/08/17 |
BaMnCO3F2 | COD | 1100121 | P6_3/m (176) | ✔ | 16 | 122 | 2 | 0.0 | 0.000 | 0.877 | (0;000) | ✗ | 02/02/17 |
V2Se9 | ICSD | 48145 | C2/c (15) | ✔ | 22 | 160 | 2 | 0.4041 | 0.452 | 0.000 | (0;000) | ✗ | 04/08/17 |
Au2Se2O7 | COD | 7209412 | Pba2 (32) | ✗ | 22 | 152 | 2 | 1.0081 | 1.035 | 0.000 | (0;000) | ✗ | 07/08/17 |
Sr3(GaP2)2 | ICSD | 423782 | C2/c (15) | ✔ | 18 | 152 | 2 | 1.0762 | 1.174 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba3Zr2S7 | COD | 2009500 | I4/mmm (139) | ✔ | 12 | 80 | 2 | 0.4227 | 0.556 | 0.000 | (0;000) | ✗ | 02/02/17 |
TeO2 | COD | 1011183 | Pbca (61) | ✔ | 24 | 144 | 2 | 0.1166 | 0.231 | 0.000 | (0;000) | ✗ | 04/08/17 |