▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ta3N5 | COD | 1528098 | Cmcm (63) | ✔ | 16 | 128 | 3 | 0.0 | 0.022 | 0.497 | (0;000) | ✗ | 02/02/17 |
MgSiO3 | COD | 2105685 | C2/c (15) | ✔ | 20 | 128 | 3 | 4.4588 | 4.459 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y3BrO4 | ICSD | 419384 | Cmcm (63) | ✔ | 16 | 128 | 3 | 4.3204 | 4.320 | 0.000 | (0;000) | ✗ | 02/02/17 |
ScGeRh | ICSD | 637682 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.001 | 0.452 | (1;000) | ✗ | 27/01/17 |
Ta3N5 | COD | 1005006 | Cmcm (63) | ✔ | 16 | 128 | 3 | 1.2557 | 1.519 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiPPbO5 | ICSD | 419125 | P-1 (2) | ✔ | 16 | 128 | 3 | 1.6308 | 1.743 | 0.000 | (0;000) | ✗ | 02/02/17 |
KNaMg2Si4(O5F)2 | ICSD | 98196 | C2/m (12) | ✔ | 20 | 128 | 2 | 5.3922 | 5.392 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsBa2Nb3O10 | ICSD | 93676 | P4/mmm (123) | ✔ | 16 | 128 | 2 | 1.7309 | 2.086 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li2RuF6 | ICSD | 165210 | P4_2/mnm (136) | ✔ | 18 | 128 | 1 | 0.067 | 0.127 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2TiSiO5 | COD | 9011189 | P4/nmm (129) | ✔ | 18 | 128 | 2 | 3.217 | 3.424 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaV2Ni3(HO5)2 | ICSD | 424330 | C2/m (12) | ✔ | 18 | 128 | 2 | 0.0 | 0.006 | 0.659 | (0;000) | ✗ | 02/02/17 |
RbSr2Nb3O10 | ICSD | 93674 | P4/mmm (123) | ✔ | 16 | 128 | 2 | 1.2847 | 1.849 | 0.000 | (0;000) | ✗ | 02/02/17 |
CIF3 | ICSD | 73268 | Cmce (64) | ✔ | 20 | 128 | 1 | 3.7955 | 3.808 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsSr2Nb3O10 | ICSD | 93675 | P4/mmm (123) | ✔ | 16 | 128 | 2 | 1.5644 | 1.938 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca(Cu2P)2 | ICSD | 62553 | P4_2/mnm (136) | ✔ | 14 | 128 | 3 | 0.0 | 0.021 | 0.267 | (1;000) | ✗ | 02/02/17 |
SnPd | COD | 9008938 | Pnma (62) | ✔ | 8 | 128 | 3 | 0.0 | 0.010 | 0.379 | (0;000) | ✗ | 27/01/17 |
SrCdPt | COD | 2240266 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.047 | 0.554 | (1;000) | ✗ | 02/02/17 |
CsSr2Ta3O10 | ICSD | 93677 | P4/mmm (123) | ✔ | 16 | 128 | 2 | 1.927 | 2.311 | 0.000 | (0;000) | ✗ | 02/02/17 |
SiCl4 | ICSD | 62279 | P2_1/c (14) | ✔ | 20 | 128 | 1 | 5.7206 | 5.794 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsPSO2 | ICSD | 20543 | P-1 (2) | ✔ | 20 | 128 | 1 | 4.3524 | 4.352 | 0.000 | (0;000) | ✗ | 02/02/17 |
ScSiRh | ICSD | 79596 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.028 | 0.421 | (0;000) | ✗ | 27/01/17 |
Ga2PbSe4 | ICSD | 635052 | Cccm (66) | ✔ | 14 | 128 | 3 | 1.4183 | 1.490 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrCO3 | COD | 9008198 | Pnma (62) | ✔ | 20 | 128 | 1 | 4.4705 | 4.482 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y4C5 | ICSD | 84869 | Pbam (55) | ✔ | 18 | 128 | 3 | 0.0 | 0.005 | 0.807 | (0;100) | ✗ | 02/02/17 |
BaNb2V2O11 | ICSD | 165097 | R-3m (166) | ✔ | 16 | 128 | 2 | 2.2681 | 2.270 | 0.000 | (0;000) | ✗ | 02/02/17 |
Os | ICSD | 27568 | P2_1/c (14) | ✔ | 8 | 128 | 1 | 0.0 | 0.001 | 0.042 | (1;001) | ✗ | 02/02/17 |
Na4SiO4 | COD | 1527119 | P-1 (2) | ✔ | 18 | 128 | 1 | 2.1219 | 2.136 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y2Pt | ICSD | 649844 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.012 | 0.457 | (0;000) | ✗ | 02/02/17 |
NaYO2 | ICSD | 2740 | C2/c (15) | ✔ | 16 | 128 | 3 | 4.2228 | 4.223 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3VSO3 | ICSD | 419400 | P2_1/m (11) | ✔ | 16 | 128 | 1 | 3.0942 | 3.135 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2TlAu3 | COD | 4302645 | Pmma (51) | ✔ | 12 | 128 | 3 | 0.0 | 0.089 | 0.281 | (1;000) | ✗ | 30/01/17 |
NaSc(SiO3)2 | COD | 9011146 | C2/c (15) | ✔ | 20 | 128 | 3 | 5.1211 | 5.277 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaSbO3 | COD | 1010156 | Fd-3m (227) | ✔ | 20 | 128 | 3 | 0.0 | 0.000 | 0.586 | (0;000) | ✗ | 02/02/17 |
NaSbO3 | COD | 4124538 | Pnma (62) | ✔ | 20 | 128 | 3 | 1.567 | 1.567 | 0.000 | (0;000) | ✗ | 02/02/17 |
P3Rh | ICSD | 647999 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.0 | 0.000 | 0.161 | (1;000) | ✗ | 02/02/17 |
YS2NO6 | COD | 2100265 | P2_1/c (14) | ✔ | 20 | 128 | 3 | 0.0 | 0.013 | 0.544 | (1;000) | ✗ | 02/02/17 |
TiAs2O7 | COD | 4030527 | C2/c (15) | ✔ | 20 | 128 | 3 | 2.933 | 3.166 | 0.000 | (0;000) | ✗ | 30/01/17 |
PdF2 | COD | 1008245 | Pa3 (205) | ✔ | 12 | 128 | 3 | 0.0 | 0.000 | 0.323 | (0;000) | ✗ | 27/01/17 |
ScCoGe | ICSD | 623584 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.037 | 0.401 | (0;000) | ✗ | 27/01/17 |
YCoGe | ICSD | 601866 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.005 | 0.570 | (1;000) | ✗ | 02/02/17 |
Ba3CaIr2O9 | ICSD | 246280 | P-3m1 (164) | ✔ | 15 | 128 | 3 | 0.0 | 0.002 | 0.470 | (0;001) | ✗ | 02/02/17 |
CaGeO3 | COD | 9000904 | Pnma (62) | ✔ | 20 | 128 | 3 | 2.1712 | 2.229 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaPS3 | ICSD | 426906 | P2_1/m (11) | ✔ | 20 | 128 | 1 | 2.0626 | 2.123 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaSc(SiO3)2 | COD | 2009802 | C2/c (15) | ✔ | 20 | 128 | 3 | 5.1238 | 5.277 | 0.000 | (0;000) | ✗ | 02/02/17 |
ScCoSi | ICSD | 420415 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.010 | 0.409 | (0;000) | ✗ | 27/01/17 |
Cs2Li3GaO4 | ICSD | 69491 | Ibam (72) | ✔ | 20 | 128 | 2 | 4.0292 | 4.029 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb2Se | ICSD | 26183 | C2/m (12) | ✔ | 12 | 128 | 3 | 0.0 | 0.015 | 0.279 | (0;111) | ✗ | 02/02/17 |
Mo2C | ICSD | 246146 | Pbcn (60) | ✔ | 12 | 128 | 3 | 0.0 | 0.031 | 0.368 | (1;000) | ✗ | 27/01/17 |
Sc2Pt | COD | 2106085 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.015 | 0.299 | (0;000) | ✗ | 02/02/17 |
KSbO3 | ICSD | 77333 | Fd-3m (227) | ✔ | 20 | 128 | 3 | 1.9306 | 2.142 | 0.000 | (0;000) | ✗ | 02/02/17 |
PdI2 | ICSD | 25120 | P2_1/c (14) | ✔ | 12 | 128 | 2 | 0.7254 | 0.743 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsCa2Ta3O10 | ICSD | 89011 | P4/mmm (123) | ✔ | 16 | 128 | 2 | 2.3868 | 2.700 | 0.000 | (0;000) | ✗ | 02/02/17 |
Mg2Hg | COD | 1523434 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.076 | 0.497 | (1;000) | ✗ | 02/02/17 |
PCl2OF | ICSD | 416167 | P2_1/c (14) | ✔ | 20 | 128 | 1 | 5.5247 | 5.615 | 0.000 | (0;000) | ✗ | 02/02/17 |
AuCl3 | COD | 2310075 | P2_1/c (14) | ✔ | 16 | 128 | 1 | 1.314 | 1.408 | 0.000 | (0;000) | ✗ | 30/01/17 |
PBr3O | COD | 2106216 | Pnma (62) | ✔ | 20 | 128 | 1 | 3.3896 | 3.488 | 0.000 | (0;000) | ✗ | 02/02/17 |
TiSiRu | ICSD | 57484 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.015 | 0.323 | (1;000) | ✗ | 27/01/17 |
GeBr4 | COD | 8102926 | P2_1/c (14) | ✔ | 20 | 128 | 1 | 3.0218 | 3.068 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Mo | ICSD | 24902 | Pnma (62) | ✔ | 12 | 128 | 1 | 0.0 | 0.009 | 0.467 | (1;000) | ✗ | 02/02/17 |
Ba6Os2N6O | ICSD | 419467 | R-3 (148) | ✔ | 15 | 128 | 1 | 0.0 | 0.007 | 0.163 | (1;000) | ✗ | 02/02/17 |
Ba3NiO4 | ICSD | 30662 | R-3c (167) | ✔ | 16 | 128 | 2 | 0.0 | 0.002 | 0.082 | (0;000) | ✗ | 02/02/17 |
Ba3SiO5 | COD | 2106454 | I4/mcm (140) | ✔ | 18 | 128 | 1 | 3.5175 | 3.553 | 0.000 | (0;000) | ✗ | 02/02/17 |
KNO3 | ICSD | 52376 | Pnma (62) | ✔ | 20 | 128 | 1 | 2.3104 | 2.310 | 0.000 | (0;000) | ✗ | 02/02/17 |
SiBr4 | COD | 2105707 | P2_1/c (14) | ✔ | 20 | 128 | 1 | 4.2129 | 4.288 | 0.000 | (0;000) | ✗ | 02/02/17 |
CoAs3 | COD | 1011231 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.0 | 0.000 | 0.101 | (1;000) | ✗ | 30/01/17 |
KNO3 | COD | 9012754 | Pnma (62) | ✔ | 20 | 128 | 1 | 3.0758 | 3.078 | 0.000 | (0;000) | ✗ | 02/02/17 |
As3Ir | COD | 9016517 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.2733 | 0.273 | 0.000 | (0;000) | ✗ | 30/01/17 |
As3Rh | COD | 9015095 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.0 | 0.000 | 0.038 | (1;000) | ✗ | 30/01/17 |
Ca2Hg | ICSD | 619362 | Pnma (62) | ✔ | 12 | 128 | 1 | 0.0 | 0.034 | 0.604 | (1;000) | ✗ | 02/02/17 |
CoP3 | COD | 1526482 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.0 | 0.000 | 0.141 | (1;000) | ✗ | 02/02/17 |
BaZrS3 | ICSD | 616104 | Pnma (62) | ✔ | 20 | 128 | 3 | 0.796 | 0.796 | 0.000 | (0;000) | ✗ | 02/02/17 |
KPO3 | ICSD | 26148 | Pnma (62) | ✔ | 20 | 128 | 1 | 4.7829 | 4.783 | 0.000 | (0;000) | ✗ | 02/02/17 |
MnCrF5 | COD | 1000158 | C2/c (15) | ✔ | 14 | 128 | 3 | 0.0 | 0.024 | 0.250 | (0;110) | ✗ | 27/01/17 |
LiRhO2 | ICSD | 59179 | Fd-3m (227) | ✔ | 16 | 128 | 3 | 1.5341 | 1.536 | 0.000 | (0;000) | ✗ | 27/01/17 |
Te3Cl2 | COD | 1522083 | P2_1/c (14) | ✔ | 20 | 128 | 3 | 1.2807 | 1.345 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ta2O | ICSD | 28387 | I-43m (217) | ✗ | 12 | 128 | 3 | 0.0 | 0.000 | 0.890 | ? | ✗ | 15/02/17 |
KAsO3 | COD | 4511752 | P2_12_12_1 (19) | ✗ | 20 | 128 | 1 | 3.9695 | 3.970 | 0.000 | (0;000) | ✗ | 21/03/17 |
CoSb3 | COD | 9015513 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.025 | 0.025 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiAsPbO5 | ICSD | 419124 | C2/m (12) | ✔ | 16 | 128 | 3 | 1.7009 | 1.885 | 0.000 | (0;000) | ✗ | 30/01/17 |
Cr2HgSe4 | ICSD | 626182 | Fd-3m (227) | ✔ | 14 | 128 | 3 | 0.0 | 0.004 | 0.236 | (0;000) | ✗ | 02/02/17 |
Cr2HgS4 | ICSD | 626162 | Fd-3m (227) | ✔ | 14 | 128 | 3 | 0.0 | 0.009 | 0.086 | (0;000) | ✗ | 02/02/17 |
RbCa2Nb3O10 | ICSD | 260289 | P4/mmm (123) | ✔ | 16 | 128 | 2 | 1.8878 | 2.242 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbCa2Ta3O10 | ICSD | 89010 | P4/mmm (123) | ✔ | 16 | 128 | 2 | 2.141 | 2.351 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr2CrFeAsO3 | ICSD | 180529 | P4/nmm (129) | ✔ | 16 | 130 | 1 | 0.0 | 0.000 | 0.894 | (1;001) | ✗ | 30/01/17 |
AsPb2Cl2O3 | COD | 9007762 | P2_1/m (11) | ✔ | 16 | 130 | 2 | 0.0 | 0.000 | 0.849 | (0;001) | ✗ | 30/01/17 |
Nb4FeP | ICSD | 632795 | P4/mcc (124) | ✔ | 12 | 130 | 3 | 0.0 | 0.000 | 0.873 | (0;110) | ✗ | 27/01/17 |
Co3W | COD | 1524836 | P6_3/mmc (194) | ✔ | 8 | 130 | 3 | 0.0 | 0.000 | 0.708 | (0;000) | ✗ | 27/01/17 |
MoRh3 | COD | 1523677 | P6_3/mmc (194) | ✔ | 8 | 130 | 3 | 0.0 | 0.000 | 0.830 | (0;000) | ✗ | 27/01/17 |
Sn5(BIr3)2 | ICSD | 78984 | P-62m (189) | ✗ | 13 | 130 | 3 | 0.0 | 0.000 | 0.323 | ? | ✗ | 06/10/16 |
CuAsF7 | ICSD | 413972 | Imma (74) | ✔ | 18 | 130 | 3 | 0.0 | 0.003 | 0.094 | (1;110) | ✗ | 30/01/17 |
Ta4FeP | ICSD | 86378 | P4/mcc (124) | ✔ | 12 | 130 | 3 | 0.0 | 0.000 | 0.735 | (1;110) | ✗ | 27/01/17 |
BaSi2CuO6 | COD | 2001087 | I4/mmm (139) | ✔ | 20 | 130 | 2 | 0.0 | 0.003 | 0.025 | (0;111) | ✗ | 02/02/17 |
Sr5Bi3 | ICSD | 41838 | P6_3/mcm (193) | ✔ | 16 | 130 | 1 | 0.0 | 0.000 | 0.580 | (1;000) | ✗ | 06/10/16 |
SrLiNiF6 | ICSD | 32733 | P-31c (163) | ✔ | 18 | 130 | 1 | 0.0 | 0.000 | 0.660 | (0;000) | ✗ | 02/02/17 |
Zr5AlPb3 | ICSD | 604194 | P6_3/mcm (193) | ✔ | 18 | 130 | 3 | 0.0 | 0.000 | 0.794 | (1;000) | ✗ | 30/01/17 |
MoIr3 | COD | 1523680 | P6_3/mmc (194) | ✔ | 8 | 130 | 3 | 0.0 | 0.000 | 0.878 | (0;000) | ✗ | 27/01/17 |
Cu5As2 | COD | 9012384 | Ibam (72) | ✔ | 14 | 130 | 3 | 0.0 | 0.000 | 0.547 | (0;111) | ✗ | 05/01/17 |
BiPd2Pb | ICSD | 58830 | Cm (8) | ✗ | 8 | 130 | 3 | 0.0 | 0.009 | 0.811 | (1;011) | ✔ | 28/11/16 |
Co(PdSe)2 | ICSD | 416513 | Ibam (72) | ✔ | 10 | 130 | 3 | 0.0 | 0.000 | 0.515 | (1;000) | ✗ | 27/01/17 |
Ba3Al3Ga2 | ICSD | 415931 | P6_3/mmc (194) | ✔ | 16 | 130 | 2 | 0.0 | 0.000 | 0.590 | (0;000) | ✗ | 30/01/17 |