▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BaZnPb | COD | 1527802 | P6_3/mmc (194) | ✔ | 6 | 72 | 2 | 0.0 | 0.007 | 0.168 | (1;000) | ✗ | 05/01/17 |
BaZnSi | COD | 1527803 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.001 | 0.295 | (0;000) | ✗ | 05/01/17 |
BaZnSn | COD | 1527804 | P6_3/mmc (194) | ✔ | 6 | 72 | 2 | 0.0 | 0.002 | 0.266 | (1;000) | ✗ | 05/01/17 |
CsFeCl4 | COD | 1527810 | Pnma (62) | ✔ | 24 | 180 | 1 | 0.0 | 0.000 | 0.545 | (1;011) | ✗ | 04/08/17 |
TlGaTe2 | COD | 1527851 | I4/mcm (140) | ✔ | 8 | 76 | 3 | 0.2219 | 0.263 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlInSe2 | COD | 1527852 | I4/mcm (140) | ✔ | 8 | 76 | 1 | 0.3952 | 0.395 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlInTe2 | COD | 1527853 | I4/mcm (140) | ✔ | 8 | 76 | 1 | 0.3005 | 0.382 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cu2As | COD | 1527863 | P4/nmm (129) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.811 | (1;000) | ✗ | 05/01/17 |
Li2Ca | COD | 1527864 | P6_3/mmc (194) | ✔ | 12 | 64 | 1 | 0.0 | 0.001 | 0.548 | (1;000) | ✗ | 02/02/17 |
CsVCl3 | COD | 1527869 | P6_3/mmc (194) | ✔ | 10 | 86 | 1 | 0.0 | 0.000 | 0.717 | (0;000) | ✗ | 02/02/17 |
TiCdF6 | COD | 1527894 | R-3 (148) | ✔ | 8 | 66 | 3 | 0.1564 | 0.162 | 0.000 | (0;000) | ✗ | 27/01/17 |
TlP5 | COD | 1527898 | Pmc2_1 (26) | ✗ | 24 | 152 | 1 | 1.0559 | 1.181 | 0.000 | (0;000) | ✗ | 04/08/17 |
NaMnO2 | COD | 1527918 | C2/m (12) | ✔ | 4 | 36 | 2 | 0.0 | 0.057 | 0.372 | (0;000) | ✗ | 27/01/17 |
TiZn2 | COD | 1527930 | P6_3/mmc (194) | ✔ | 12 | 144 | 3 | 0.0 | 0.002 | 0.727 | (0;000) | ✗ | 27/01/17 |
TiZn3 | COD | 1527931 | Pm-3m (221) | ✔ | 4 | 48 | 3 | 0.0 | 0.000 | 0.713 | (1;111) | ✗ | 27/01/17 |
Ti2Sn | COD | 1527932 | P6_3/mmc (194) | ✔ | 6 | 76 | 3 | 0.0 | 0.016 | 0.013 | (0;000) | ✗ | 27/01/17 |
PbWO4 | COD | 1527935 | I4_1/a (88) | ✔ | 12 | 132 | 2 | 0.0 | 0.010 | 0.310 | (1;111) | ✗ | 11/04/17 |
NaMnF3 | COD | 1527946 | Pnma (62) | ✔ | 20 | 180 | 3 | 0.0 | 0.001 | 0.366 | (0;110) | ✗ | 02/02/17 |
Ca4Al6O13 | COD | 1527947 | I-43m (217) | ✗ | 23 | 136 | 3 | 3.3952 | 3.473 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsSnCl3 | COD | 1527954 | P2_1/c (14) | ✔ | 20 | 176 | 1 | 2.8109 | 2.811 | 0.000 | (0;000) | ✗ | 02/02/17 |
TiRu | COD | 1527977 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.006 | 0.272 | (1;111) | ✗ | 27/01/17 |
Ca2GeO4 | COD | 1527982 | I4/mmm (139) | ✔ | 7 | 48 | 2 | 3.1506 | 3.559 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sc2Si2O7 | COD | 1527983 | Fd-3m (227) | ✔ | 22 | 144 | 3 | 3.6197 | 3.645 | 0.000 | (0;000) | ✗ | 04/08/17 |
In2Si2O7 | COD | 1527984 | Fd-3m (227) | ✔ | 22 | 152 | 3 | 2.1883 | 2.640 | 0.000 | (0;000) | ✗ | 04/08/17 |
Zr3Sn | COD | 1528001 | Pm-3n (223) | ✔ | 8 | 52 | 3 | 0.0 | 0.002 | 0.932 | (1;000) | ✗ | 27/01/17 |
KTlO | COD | 1528008 | C2/m (12) | ✔ | 6 | 56 | 1 | 1.2719 | 1.734 | 0.000 | (0;000) | ✗ | 27/01/17 |
Al2CuCl8 | COD | 1528015 | P2_1/c (14) | ✔ | 22 | 146 | 2 | 0.0 | 0.000 | 0.655 | (0;000) | ✗ | 04/08/17 |
Cu3P | COD | 1528021 | P-3m1 (164) | ✔ | 8 | 76 | 3 | 0.0 | 0.013 | 0.548 | (1;000) | ✗ | 27/01/17 |
Cr3O | COD | 1528029 | Pm-3n (223) | ✔ | 8 | 96 | 3 | 0.0 | 0.009 | 0.762 | (1;000) | ✗ | 27/01/17 |
Li2ZnSi | COD | 1528031 | P-3m1 (164) | ✔ | 16 | 88 | 1 | 0.0 | 0.245 | 0.364 | (0;000) | ✗ | 02/02/17 |
Ti6Sn5 | COD | 1528037 | P6_3/mmc (194) | ✔ | 22 | 284 | 3 | 0.0 | 0.001 | 0.764 | (0;000) | ✗ | 08/08/17 |
V4Zn5 | COD | 1528038 | I4/mmm (139) | ✔ | 9 | 112 | 3 | 0.0 | 0.002 | 0.859 | (0;000) | ✗ | 27/01/17 |
TiAl2 | COD | 1528043 | Cmmm (65) | ✔ | 6 | 36 | 3 | 0.0 | 0.010 | 0.449 | (1;110) | ✗ | 05/01/17 |
KBiO2 | COD | 1528047 | C2/c (15) | ✔ | 8 | 72 | 1 | 1.2352 | 1.245 | 0.000 | (0;000) | ✗ | 05/01/17 |
RbTaO3 | COD | 1528059 | C2/m (12) | ✔ | 20 | 160 | 2 | 3.6926 | 3.756 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb9O2 | COD | 1528075 | P2_1/m (11) | ✔ | 22 | 186 | 1 | 0.0 | 0.000 | 0.830 | (1;010) | ✗ | 07/08/17 |
Nb3Se4 | COD | 1528080 | P6_3/m (176) | ✔ | 14 | 126 | 3 | 0.0 | 0.000 | 0.972 | (1;000) | ✗ | 02/02/17 |
Sc2Si2O7 | COD | 1528085 | C2/m (12) | ✔ | 11 | 72 | 3 | 4.4236 | 4.615 | 0.000 | (0;000) | ✗ | 27/01/17 |
YO2 | COD | 1528091 | P2_1/c (14) | ✔ | 12 | 92 | 3 | 0.0 | 0.003 | 0.446 | (0;010) | ✗ | 02/02/17 |
Li5AlO4 | COD | 1528092 | Pmmn (59) | ✔ | 20 | 84 | 1 | 4.9075 | 4.995 | 0.000 | (0;000) | ✗ | 05/01/17 |
MoNCl3 | COD | 1528097 | P-1 (2) | ✔ | 20 | 160 | 2 | 1.7625 | 1.819 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ta3N5 | COD | 1528098 | Cmcm (63) | ✔ | 16 | 128 | 3 | 0.0 | 0.022 | 0.497 | (0;000) | ✗ | 02/02/17 |
CaIn2Cu | COD | 1528108 | Cmcm (63) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.762 | (0;110) | ✗ | 27/01/17 |
CaIn4Ni | COD | 1528112 | Cmcm (63) | ✔ | 12 | 144 | 3 | 0.0 | 0.004 | 0.793 | (1;110) | ✗ | 02/02/17 |
YCl3 | COD | 1528118 | C2/m (12) | ✔ | 8 | 64 | 2 | 4.6408 | 4.771 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaPbO3 | COD | 1528128 | Imma (74) | ✔ | 10 | 84 | 3 | 0.1566 | 0.157 | 0.000 | (0;000) | ✗ | 05/01/17 |
Li8SnO6 | COD | 1528146 | R-3 (148) | ✔ | 15 | 74 | 1 | 3.6772 | 3.690 | 0.000 | (0;000) | ✗ | 27/01/17 |
Cs3O | COD | 1528149 | P6_3/mcm (193) | ✔ | 8 | 66 | 1 | 0.0 | 0.000 | 0.699 | (1;001) | ✗ | 02/02/17 |
Ca7Ni4Sn13 | COD | 1528162 | P4/m (83) | ✔ | 24 | 292 | 3 | 0.0 | 0.003 | 0.911 | (1;110) | ✗ | 04/08/17 |
K2Cd2O3 | COD | 1528164 | P2_1/c (14) | ✔ | 14 | 120 | 3 | 0.7106 | 0.711 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr3Li2 | COD | 1528178 | P4_2/mnm (136) | ✔ | 20 | 144 | 1 | 0.0 | 0.000 | 0.522 | (1;000) | ✗ | 29/03/17 |
Ti(NCl)3 | COD | 1528192 | P-1 (2) | ✔ | 14 | 96 | 1 | 2.4342 | 2.479 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr2Sn | COD | 1528200 | Pnma (62) | ✔ | 12 | 136 | 1 | 0.1881 | 0.188 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbScO2 | COD | 1528203 | P6_3/mmc (194) | ✔ | 8 | 64 | 2 | 3.4955 | 3.922 | 0.000 | (0;000) | ✗ | 27/01/17 |
KCuCl3 | COD | 1528208 | P2_1/c (14) | ✔ | 20 | 164 | 1 | 0.0 | 0.004 | 0.065 | (0;000) | ✗ | 02/02/17 |
ZnGeN2 | COD | 1528213 | Pna2_1 (33) | ✗ | 16 | 104 | 3 | 1.8898 | 1.890 | 0.000 | (0;000) | ✗ | 15/02/17 |
Rb2CuCl4 | COD | 1528214 | Cmce (64) | ✔ | 14 | 114 | 2 | 0.0 | 0.000 | 0.938 | (0;000) | ✗ | 02/02/17 |
CrSn2 | COD | 1528217 | Fddd (70) | ✔ | 12 | 168 | 3 | 0.0 | 0.010 | 0.440 | (1;111) | ✗ | 02/02/17 |
VSn2 | COD | 1528218 | Fddd (70) | ✔ | 12 | 164 | 3 | 0.0 | 0.010 | 0.598 | (1;111) | ✗ | 02/02/17 |
NbSn2 | COD | 1528219 | Fddd (70) | ✔ | 12 | 164 | 3 | 0.0 | 0.004 | 0.590 | (1;111) | ✗ | 02/02/17 |
YCo5 | COD | 1528221 | P6/mmm (191) | ✔ | 6 | 96 | 3 | 0.0 | 0.005 | 0.817 | (0;000) | ✗ | 27/01/17 |
MnF2 | COD | 1528224 | P-42m (111) | ✗ | 12 | 116 | 3 | 0.0 | 0.001 | 0.621 | ? | ✗ | 15/02/17 |
RbAu5 | COD | 1528238 | P6/mmm (191) | ✔ | 6 | 64 | 3 | 0.0 | 0.024 | 0.498 | (1;001) | ✗ | 05/01/17 |
Li8Pb3 | COD | 1528240 | R-3m (166) | ✔ | 11 | 66 | 1 | 0.0 | 0.158 | 0.632 | (1;111) | ✗ | 02/02/17 |
CsMnI3 | COD | 1528241 | P6_3/mmc (194) | ✔ | 10 | 90 | 1 | 0.0 | 0.001 | 0.698 | (0;000) | ✗ | 02/02/17 |
RbCrI3 | COD | 1528243 | C2 (5) | ✗ | 20 | 176 | 2 | 0.0 | 0.001 | 0.604 | ? | ✗ | 22/03/17 |
K3(NiO2)2 | COD | 1528246 | Cmcm (63) | ✔ | 18 | 142 | 3 | 0.0 | 0.000 | 0.748 | (0;000) | ✗ | 02/02/17 |
K3(PtO2)2 | COD | 1528247 | Cmcm (63) | ✔ | 18 | 142 | 3 | 0.0 | 0.000 | 0.390 | (0;000) | ✗ | 02/02/17 |
Te2Ru | COD | 1528256 | Pnnm (58) | ✔ | 6 | 56 | 3 | 0.2 | 1.021 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2Cr2O7 | COD | 1528259 | C2/m (12) | ✔ | 22 | 176 | 1 | 0.0467 | 0.211 | 0.000 | (0;000) | ✗ | 07/08/17 |
PBr5 | COD | 1528267 | Pbcm (57) | ✔ | 24 | 160 | 1 | 2.1153 | 2.243 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiVS2 | COD | 1528269 | P-3m1 (164) | ✔ | 4 | 28 | 2 | 0.0 | 0.000 | 0.446 | (0;000) | ✗ | 27/01/17 |
MgP4 | COD | 1528274 | P2_1/c (14) | ✔ | 10 | 60 | 1 | 0.6681 | 0.668 | 0.000 | (0;000) | ✗ | 27/01/17 |
BiI | COD | 1528275 | C2/m (12) | ✔ | 16 | 176 | 1 | 0.1378 | 0.149 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiI | COD | 1528276 | C2/m (12) | ✔ | 8 | 88 | 1 | 0.1394 | 0.155 | 0.000 | (0;001) | ✗ | 02/02/17 |
NaP | COD | 1528277 | P2_12_12_1 (19) | ✗ | 16 | 112 | 1 | 0.8664 | 0.916 | 0.000 | (0;000) | ✗ | 29/03/17 |
KP | COD | 1528278 | P2_12_12_1 (19) | ✗ | 16 | 112 | 1 | 1.2133 | 1.213 | 0.000 | (0;000) | ✗ | 29/03/17 |
Mg3NF3 | COD | 1528307 | Pm-3m (221) | ✔ | 7 | 56 | 3 | 3.7906 | 3.791 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mg2NF | COD | 1528308 | I4_1/amd (141) | ✔ | 8 | 64 | 3 | 0.0 | 0.039 | 0.077 | (1;111) | ✗ | 27/01/17 |
Mn(FeO2)2 | COD | 1528316 | Fd-3m (227) | ✔ | 14 | 110 | 3 | 0.0 | 0.000 | 0.638 | (0;000) | ✗ | 27/01/17 |
SbOF | COD | 1528321 | Pnma (62) | ✔ | 12 | 72 | 1 | 0.0 | 3.503 | 1.000 | (0;000) | ✗ | 27/01/17 |
TiAs | COD | 1528330 | P6_3/mmc (194) | ✔ | 8 | 68 | 3 | 0.0 | 0.005 | 0.547 | (1;000) | ✗ | 05/01/17 |
Ta5Si3 | COD | 1528331 | I4/mcm (140) | ✔ | 16 | 154 | 3 | 0.0 | 0.001 | 0.642 | (0;111) | ✗ | 02/02/17 |
VCdO3 | COD | 1528346 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.000 | 0.658 | (0;110) | ✗ | 02/02/17 |
Sc3As2 | COD | 1528350 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.000 | 0.912 | (1;011) | ✗ | 21/03/17 |
Sr2NCl | COD | 1528370 | R-3m (166) | ✔ | 4 | 32 | 1 | 1.8349 | 1.835 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2BrN | COD | 1528372 | R-3m (166) | ✔ | 4 | 32 | 1 | 1.8948 | 1.895 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2IN | COD | 1528373 | R-3m (166) | ✔ | 4 | 32 | 2 | 0.0 | 0.003 | 0.437 | (1;000) | ✗ | 30/01/17 |
TaF5 | COD | 1528377 | C2/m (12) | ✔ | 24 | 192 | 2 | 5.8166 | 5.835 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ge2Mo | COD | 1528384 | Pnma (62) | ✔ | 12 | 88 | 3 | 0.0 | 0.026 | 0.156 | (1;000) | ✗ | 27/01/17 |
SrZrO3 | COD | 1528398 | Pnma (62) | ✔ | 20 | 128 | 3 | 3.1899 | 3.190 | 0.000 | (0;000) | ✗ | 02/02/17 |
Co2C | COD | 1528415 | Pnnm (58) | ✔ | 6 | 76 | 3 | 0.0 | 0.020 | 0.325 | (0;000) | ✗ | 27/01/17 |
Li2PdO2 | COD | 1528454 | Immm (71) | ✔ | 5 | 36 | 1 | 1.3852 | 1.861 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr3(SiAs2)2 | COD | 1528461 | C2/c (15) | ✔ | 18 | 116 | 1 | 0.8782 | 0.878 | 0.000 | (0;000) | ✗ | 30/01/17 |
BaRuO3 | COD | 1528493 | R-3m (166) | ✔ | 15 | 132 | 3 | 0.0 | 0.014 | 0.310 | (0;111) | ✗ | 02/02/17 |
CuGeO3 | COD | 1528527 | Pmma (51) | ✔ | 10 | 66 | 3 | 0.0 | 0.000 | 0.683 | (1;010) | ✗ | 27/01/17 |
Al2W | COD | 1528542 | P6_422 (181) | ✗ | 9 | 60 | 3 | 0.0 | 0.001 | 0.529 | ? | ✗ | 15/02/17 |
SrLiSb | COD | 1528545 | Pnma (62) | ✔ | 12 | 72 | 1 | 0.4973 | 0.497 | 0.000 | (0;000) | ✗ | 02/02/17 |
InF3 | COD | 1528562 | R-3c (167) | ✔ | 8 | 68 | 3 | 0.0 | 0.001 | 0.075 | (0;000) | ✗ | 27/01/17 |
TlF3 | COD | 1528563 | Pnma (62) | ✔ | 16 | 136 | 3 | 1.4643 | 1.525 | 0.000 | (0;000) | ✗ | 27/01/17 |