▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BNCl2 | ICSD | 28168 | R3 (146) | ✗ | 12 | 66 | 1 | 2.288 | 2.326 | 0.000 | (0;000) | ✗ | 06/10/16 |
Li2SiO3 | ICSD | 28192 | Ccm2_1 (36) | ✗ | 12 | 56 | 2 | 5.2008 | 5.421 | 0.000 | (0;000) | ✗ | 06/10/16 |
Y2Si2O7 | ICSD | 28212 | P2_1/c (14) | ✔ | 22 | 144 | 3 | 4.0515 | 4.052 | 0.000 | (0;000) | ✗ | 04/08/17 |
AgI | ICSD | 28230 | P4/nmm (129) | ✔ | 4 | 36 | 2 | 1.0238 | 1.024 | 0.000 | (0;000) | ✗ | 06/10/16 |
RhBr3 | ICSD | 28245 | C2/m (12) | ✔ | 8 | 76 | 2 | 1.23 | 1.361 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaNb2O6 | ICSD | 28253 | Pmma (51) | ✔ | 18 | 144 | 3 | 1.3837 | 1.410 | 0.000 | (0;000) | ✗ | 02/02/17 |
SbSI | ICSD | 28263 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.4604 | 1.638 | 0.000 | (0;000) | ✗ | 06/10/16 |
SbSI | ICSD | 28264 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.3387 | 1.481 | 0.000 | (0;000) | ✗ | 06/10/16 |
MgSn(BO3)2 | ICSD | 28266 | R-3 (148) | ✔ | 10 | 66 | 3 | 2.8625 | 2.973 | 0.000 | (0;000) | ✗ | 05/01/17 |
SrSn(BO3)2 | ICSD | 28267 | R-3 (148) | ✔ | 10 | 66 | 2 | 2.234 | 2.378 | 0.000 | (0;000) | ✗ | 05/01/17 |
LiNbO3 | ICSD | 28294 | R3c (161) | ✗ | 10 | 68 | 3 | 3.4374 | 3.461 | 0.000 | (0;000) | ✗ | 06/10/16 |
SbSI | ICSD | 28304 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.4081 | 1.570 | 0.000 | (0;000) | ✗ | 06/10/16 |
SbSI | ICSD | 28305 | Pnma (62) | ✔ | 12 | 72 | 1 | 1.329 | 1.450 | 0.000 | (0;000) | ✗ | 02/02/17 |
SbSI | ICSD | 28306 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.3559 | 1.468 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsPbBr3 | ICSD | 28312 | Pnma (62) | ✔ | 20 | 176 | 2 | 2.4002 | 2.502 | 0.000 | (0;000) | ✗ | 02/02/17 |
NO2 | ICSD | 28331 | P2_1/c (14) | ✔ | 12 | 68 | 1 | 2.5717 | 2.624 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2NiWO6 | ICSD | 28342 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.684 | (0;000) | ✗ | 05/01/17 |
H2 | ICSD | 28344 | P6_3/mmc (194) | ✔ | 2 | 2 | 1 | 0.0 | 0.000 | 0.621 | (1;000) | ✗ | 27/01/17 |
CsAlO2 | ICSD | 28372 | Fd-3m (227) | ✔ | 8 | 48 | 3 | 4.8428 | 4.850 | 0.000 | (0;000) | ✗ | 05/01/17 |
RbAlO2 | ICSD | 28373 | Fd-3m (227) | ✔ | 8 | 48 | 3 | 3.7643 | 3.769 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ta2O | ICSD | 28387 | I-43m (217) | ✗ | 12 | 128 | 3 | 0.0 | 0.000 | 0.890 | ? | ✗ | 15/02/17 |
LiGaO2 | ICSD | 28388 | R-3m (166) | ✔ | 4 | 28 | 2 | 4.0872 | 4.268 | 0.000 | (0;000) | ✗ | 27/01/17 |
Hg3(ClO)2 | ICSD | 28399 | P2_1/c (14) | ✔ | 14 | 124 | 3 | 0.0 | 0.082 | 0.044 | (0;000) | ✗ | 02/02/17 |
HgSO4 | ICSD | 28402 | Pc (7) | ✗ | 12 | 84 | 3 | 0.9664 | 1.331 | 0.000 | (0;000) | ✗ | 06/10/16 |
Te2SO7 | ICSD | 28468 | Pmn2_1 (31) | ✗ | 20 | 120 | 3 | 2.0951 | 2.120 | 0.000 | (0;000) | ✗ | 29/03/17 |
CoAg3(CN)6 | ICSD | 28501 | P-31m (162) | ✔ | 16 | 104 | 3 | 3.2465 | 3.377 | 0.000 | (0;000) | ✗ | 02/02/17 |
CoH3(CN)6 | ICSD | 28502 | P-31m (162) | ✔ | 16 | 74 | 3 | 4.1114 | 4.130 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiScMo3O8 | ICSD | 28525 | P3m1 (156) | ✗ | 13 | 104 | 3 | 0.8112 | 0.811 | 0.000 | (0;000) | ✗ | 15/02/17 |
LiYMo3O8 | ICSD | 28526 | P3m1 (156) | ✗ | 13 | 104 | 3 | 0.9313 | 0.931 | 0.000 | (0;000) | ✗ | 15/02/17 |
PtCl2 | ICSD | 28527 | R-3m (166) | ✔ | 18 | 144 | 2 | 0.6796 | 0.680 | 0.000 | (0;000) | ✗ | 02/02/17 |
O2 | ICSD | 28530 | P4/mmm (123) | ✔ | 1 | 6 | 1 | 0.0 | 0.025 | 0.322 | (0;000) | ✗ | 27/01/17 |
RbBe2F5 | ICSD | 28541 | P1 (1) | ✗ | 8 | 52 | 2 | 6.8553 | 6.858 | 0.000 | (0;000) | ✗ | 06/10/16 |
KIO3 | ICSD | 28545 | Pm-3m (221) | ✔ | 5 | 34 | 3 | 0.0 | 0.091 | 0.116 | (1;111) | ✗ | 30/01/17 |
Sr2ZnWO6 | ICSD | 28599 | Fm-3m (225) | ✔ | 10 | 82 | 3 | 0.0 | 0.128 | 0.064 | (0;000) | ✗ | 27/01/17 |
Sr2NiMoO6 | ICSD | 28600 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.768 | (0;000) | ✗ | 27/01/17 |
Sr2ZnMoO6 | ICSD | 28602 | Fm-3m (225) | ✔ | 10 | 82 | 3 | 1.3459 | 1.555 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrGeO3 | ICSD | 28603 | P-62m (189) | ✗ | 15 | 96 | 1 | 1.7626 | 1.776 | 0.000 | (0;000) | ✗ | 22/03/17 |
NaTaO3 | ICSD | 28617 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 2.2699 | 2.960 | 0.000 | (0;000) | ✗ | 27/01/17 |
AlP2 | ICSD | 28672 | Ia3 (206) | ✔ | 24 | 104 | 3 | 0.0 | 0.001 | 0.662 | (1;000) | ✗ | 04/08/17 |
AlAs2 | ICSD | 28673 | Ia3 (206) | ✔ | 24 | 104 | 3 | 0.0 | 0.003 | 0.763 | (0;111) | ✗ | 04/08/17 |
Cs2PdF6 | ICSD | 28674 | Fm-3m (225) | ✔ | 9 | 78 | 1 | 2.4653 | 2.524 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2PdF6 | ICSD | 28675 | Fm-3m (225) | ✔ | 9 | 78 | 1 | 3.1644 | 3.164 | 0.000 | (0;000) | ✗ | 27/01/17 |
AlCuTe2 | ICSD | 28735 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.3259 | 1.326 | 0.000 | (0;000) | ✗ | 16/03/17 |
GaCuTe2 | ICSD | 28738 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.2411 | 0.241 | 0.000 | (0;000) | ✔ | 07/10/16 |
TlCuS2 | ICSD | 28742 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.014 | 0.072 | (1;000) | ✔ | 07/10/16 |
TlCuSe2 | ICSD | 28743 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.014 | 0.004 | (1;000) | ✔ | 07/10/16 |
AlAgS2 | ICSD | 28744 | I-42d (122) | ✗ | 8 | 52 | 3 | 2.0803 | 2.120 | 0.000 | (0;000) | ✗ | 07/10/16 |
AlAgSe2 | ICSD | 28745 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.0674 | 1.073 | 0.000 | (0;000) | ✗ | 07/10/16 |
AlAgTe2 | ICSD | 28746 | I-42d (122) | ✗ | 8 | 52 | 3 | 0.846 | 0.850 | 0.000 | (0;000) | ✗ | 07/10/16 |
InAgSe2 | ICSD | 28751 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.034 | 0.023 | (1;000) | ✔ | 07/10/16 |