▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
LiAuI4 | COD | 1510187 | P2_1/c (14) | ✔ | 12 | 84 | 1 | 0.4995 | 0.624 | 0.000 | (0;000) | ✗ | 02/02/17 |
TaAgS3 | COD | 1509528 | Cmcm (63) | ✔ | 10 | 84 | 3 | 0.0 | 0.019 | 0.136 | (1;000) | ✗ | 05/01/17 |
AgP2 | COD | 1509504 | P2_1/c (14) | ✔ | 12 | 84 | 2 | 0.6145 | 0.626 | 0.000 | (0;000) | ✗ | 30/01/17 |
LiYF4 | COD | 1531438 | C2/c (15) | ✔ | 12 | 84 | 3 | 7.555 | 7.555 | 0.000 | (0;000) | ✗ | 27/01/17 |
Al2ZnO4 | COD | 9007027 | Fd-3m (227) | ✔ | 14 | 84 | 3 | 4.3543 | 4.357 | 0.000 | (0;000) | ✗ | 05/01/17 |
LiYF4 | COD | 1531435 | I4_1/a (88) | ✔ | 12 | 84 | 3 | 8.7447 | 8.766 | 0.000 | (0;000) | ✗ | 27/01/17 |
CdSO4 | ICSD | 60571 | Cmcm (63) | ✔ | 12 | 84 | 3 | 2.6303 | 3.091 | 0.000 | (0;000) | ✗ | 27/01/17 |
HgC2(SeN)2 | ICSD | 85760 | P2_1/c (14) | ✔ | 14 | 84 | 2 | 2.326 | 2.434 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiScF4 | ICSD | 413966 | I4_1/a (88) | ✔ | 12 | 84 | 3 | 6.3135 | 6.319 | 0.000 | (0;000) | ✗ | 27/01/17 |
HgC2(NO)2 | ICSD | 245329 | Cmce (64) | ✔ | 14 | 84 | 2 | 3.7029 | 3.807 | 0.000 | (0;000) | ✗ | 02/02/17 |
BrF5 | ICSD | 31690 | Ccm2_1 (36) | ✗ | 12 | 84 | 1 | 4.0507 | 4.134 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiAlPHO5 | ICSD | 68921 | P-1 (2) | ✔ | 18 | 84 | 3 | 6.1578 | 6.188 | 0.000 | (0;000) | ✗ | 05/01/17 |
CsC2N5 | COD | 4320904 | C2/c (15) | ✔ | 16 | 84 | 1 | 4.5738 | 4.606 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li5AlO4 | COD | 1528092 | Pmmn (59) | ✔ | 20 | 84 | 1 | 4.9075 | 4.995 | 0.000 | (0;000) | ✗ | 05/01/17 |
Nb3Al | ICSD | 608653 | Pm-3n (223) | ✔ | 8 | 84 | 3 | 0.0 | 0.012 | 0.550 | (0;000) | ✗ | 05/01/17 |
Na2SO3 | COD | 1010523 | P-3 (147) | ✔ | 12 | 84 | 1 | 4.0495 | 4.171 | 0.000 | (0;000) | ✗ | 27/01/17 |
AlV3 | ICSD | 609614 | Pm-3n (223) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.696 | (0;000) | ✗ | 05/01/17 |
Al2CdSe4 | ICSD | 606347 | Fd-3m (227) | ✔ | 14 | 84 | 3 | 1.4954 | 1.495 | 0.000 | (0;000) | ✗ | 30/01/17 |
Al2CdS4 | ICSD | 43025 | Fd-3m (227) | ✔ | 14 | 84 | 3 | 2.3691 | 2.369 | 0.000 | (0;000) | ✗ | 30/01/17 |
GeIr | COD | 9008933 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.000 | 0.573 | (0;011) | ✗ | 27/01/17 |
NiSbS | ICSD | 93900 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.565 | ? | ✗ | 06/10/16 |
Al2(FeSi)3 | COD | 2005761 | P-1 (2) | ✔ | 16 | 84 | 3 | 0.0 | 0.087 | 0.028 | (0;000) | ✗ | 30/01/17 |
PdSeO3 | COD | 4333283 | P2_1/m (11) | ✔ | 10 | 84 | 2 | 1.0869 | 1.368 | 0.000 | (0;000) | ✗ | 27/01/17 |
Al2HgSe4 | ICSD | 608163 | Fd-3m (227) | ✔ | 14 | 84 | 3 | 0.5405 | 0.541 | 0.000 | (0;000) | ✗ | 30/01/17 |
Al2HgS4 | ICSD | 608160 | Fd-3m (227) | ✔ | 14 | 84 | 3 | 1.5745 | 1.575 | 0.000 | (0;000) | ✗ | 30/01/17 |
PdSeO3 | ICSD | 415955 | C2/m (12) | ✔ | 10 | 84 | 2 | 0.6437 | 0.644 | 0.000 | (0;000) | ✗ | 27/01/17 |
BiTePd | ICSD | 70060 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.727 | ? | ✗ | 06/10/16 |
TiHgO3 | COD | 1528887 | R-3c (167) | ✔ | 10 | 84 | 3 | 1.4307 | 1.431 | 0.000 | (0;000) | ✗ | 27/01/17 |
BiTePt | ICSD | 42549 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.739 | ? | ✗ | 06/10/16 |
Ca3Zn | ICSD | 184359 | Cmcm (63) | ✔ | 8 | 84 | 1 | 0.0 | 0.002 | 0.471 | (1;110) | ✗ | 02/02/17 |
NaO2 | ICSD | 26582 | Pa3 (205) | ✔ | 12 | 84 | 1 | 0.0 | 0.000 | 0.289 | (0;111) | ✗ | 27/01/17 |
SiIr | COD | 1527672 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.002 | 0.353 | (0;011) | ✗ | 27/01/17 |
Al2ZnS4 | COD | 2310489 | Fd-3m (227) | ✔ | 14 | 84 | 3 | 2.1345 | 2.135 | 0.000 | (0;000) | ✗ | 30/01/17 |
Al2ZnSe4 | ICSD | 609325 | Fd-3m (227) | ✔ | 14 | 84 | 3 | 1.4262 | 1.426 | 0.000 | (0;000) | ✗ | 30/01/17 |
Sb2Au | COD | 9016730 | Pa3 (205) | ✔ | 12 | 84 | 3 | 0.0 | 0.000 | 0.781 | (1;111) | ✗ | 02/02/17 |
SrSnO3 | ICSD | 153532 | I4/mcm (140) | ✔ | 10 | 84 | 3 | 1.4616 | 1.462 | 0.000 | (0;000) | ✗ | 27/01/17 |
AsRu | ICSD | 611293 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.175 | (0;011) | ✗ | 05/01/17 |
RbTiCl3 | ICSD | 49747 | P6_3/mmc (194) | ✔ | 10 | 84 | 1 | 0.0 | 0.016 | 0.517 | (0;000) | ✗ | 02/02/17 |
Ti2O3 | COD | 9008082 | R-3c (167) | ✔ | 10 | 84 | 3 | 0.0 | 0.006 | 0.366 | (1;000) | ✗ | 27/01/17 |
Ba(SbAu)2 | ICSD | 416298 | P2_1/m (11) | ✔ | 10 | 84 | 3 | 0.0 | 0.024 | 0.423 | (1;000) | ✗ | 30/01/17 |
K3Bi | COD | 1010295 | P6_3/mmc (194) | ✔ | 8 | 84 | 1 | 0.0 | 0.006 | 0.037 | (0;000) | ✗ | 02/02/17 |
K2NaMnF6 | ICSD | 61117 | I4/mmm (139) | ✔ | 10 | 84 | 1 | 0.0 | 0.052 | 0.331 | (0;000) | ✗ | 27/01/17 |
Cs2NaBiCl6 | ICSD | 59195 | Fm-3m (225) | ✔ | 10 | 84 | 2 | 2.9309 | 3.206 | 0.000 | (0;000) | ✗ | 02/02/17 |
AlSCl3O2 | COD | 4309364 | P-1 (2) | ✔ | 14 | 84 | 1 | 4.238 | 4.294 | 0.000 | (0;000) | ✗ | 30/01/17 |
LiAuF4 | COD | 1510140 | C2/c (15) | ✔ | 12 | 84 | 3 | 1.2487 | 1.249 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ti2O3 | COD | 1010582 | R-3c (167) | ✔ | 10 | 84 | 3 | 0.0 | 0.017 | 0.140 | (0;000) | ✗ | 27/01/17 |
Cs2KBiF6 | ICSD | 9383 | Fm-3m (225) | ✔ | 10 | 84 | 1 | 4.0251 | 4.138 | 0.000 | (0;000) | ✗ | 02/02/17 |
GaH5(NF)2 | ICSD | 410880 | C2/m (12) | ✔ | 20 | 84 | 2 | 3.1791 | 3.354 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li6MgBr8 | ICSD | 73275 | Fm-3m (225) | ✔ | 15 | 84 | 2 | 4.5805 | 4.581 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2RbBiF6 | ICSD | 9384 | Fm-3m (225) | ✔ | 10 | 84 | 3 | 4.0212 | 4.051 | 0.000 | (0;000) | ✗ | 02/02/17 |