▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Rb2Ag4S3 | COD | 8100498 | C2/m (12) | ✔ | 18 | 160 | 1 | 0.2015 | 0.202 | 0.000 | (0;000) | ✗ | 30/01/17 |
Rb2GeS3 | COD | 8100500 | C2/m (12) | ✔ | 12 | 80 | 1 | 2.3151 | 2.399 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2Cr2O7 | COD | 8100514 | P-1 (2) | ✔ | 22 | 176 | 1 | 2.8086 | 2.822 | 0.000 | (0;000) | ✗ | 07/08/17 |
KSb(PS3)2 | COD | 8100520 | P2_1 (4) | ✗ | 20 | 120 | 2 | 2.212 | 2.233 | 0.000 | (0;000) | ✗ | 29/03/17 |
Bi | COD | 8100521 | C2/m (12) | ✔ | 2 | 30 | 3 | 0.0 | 0.042 | 0.657 | (0;001) | ✗ | 05/01/17 |
Sc2Sb | COD | 8100587 | P4/nmm (129) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.836 | (1;000) | ✗ | 27/01/17 |
In7Pt3 | COD | 8100596 | Im-3m (229) | ✔ | 20 | 242 | 3 | 0.0 | 0.000 | 0.798 | (1;000) | ✗ | 02/02/17 |
K2H4OsO6 | COD | 8100724 | I4/mmm (139) | ✔ | 13 | 74 | 1 | 0.2304 | 0.268 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2WCl6 | COD | 8100738 | Fm-3m (225) | ✔ | 9 | 74 | 1 | 0.0 | 0.000 | 0.352 | (0;000) | ✗ | 02/02/17 |
Li4HN | COD | 8100739 | I4_1/a (88) | ✔ | 12 | 36 | 1 | 2.0734 | 2.437 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrB12 | COD | 8100740 | Fm-3m (225) | ✔ | 13 | 40 | 3 | 0.0 | 0.000 | 0.844 | (1;000) | ✗ | 05/01/17 |
RbCu3S2 | COD | 8100809 | C2/m (12) | ✔ | 12 | 108 | 1 | 0.4589 | 0.459 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbGaCl4 | COD | 8100813 | Pnma (62) | ✔ | 24 | 200 | 1 | 4.7981 | 4.798 | 0.000 | (0;000) | ✗ | 04/08/17 |
KAs | COD | 8100816 | P2_12_12_1 (19) | ✗ | 16 | 112 | 1 | 0.7419 | 0.743 | 0.000 | (0;000) | ✗ | 21/03/17 |
YCuAs2 | COD | 8100824 | P4/nmm (129) | ✔ | 8 | 64 | 3 | 0.0 | 0.048 | 0.338 | (1;000) | ✗ | 05/01/17 |
HgH3IO6 | COD | 8100888 | P1 (1) | ✗ | 11 | 58 | 3 | 1.1757 | 1.205 | 0.000 | (0;000) | ✗ | 15/02/17 |
Cs6Si2NiO8 | COD | 8100892 | P-1 (2) | ✔ | 17 | 120 | 3 | 1.1286 | 1.149 | 0.000 | (0;000) | ✗ | 02/02/17 |
GaF3 | COD | 8100893 | R-3c (167) | ✔ | 8 | 68 | 3 | 5.2468 | 5.247 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaSb2 | COD | 8100903 | P2_1/m (11) | ✔ | 6 | 40 | 1 | 0.0 | 0.056 | 0.102 | (0;010) | ✗ | 02/02/17 |
Cd4GeSe6 | COD | 8100910 | Cc (9) | ✗ | 22 | 176 | 3 | 0.7097 | 0.710 | 0.000 | (0;000) | ✗ | 07/08/17 |
Ca2PbAu2 | COD | 8100914 | P4/mbm (127) | ✔ | 10 | 112 | 3 | 0.0 | 0.021 | 0.638 | (1;000) | ✗ | 30/01/17 |
CrAg3ClO4 | COD | 8100983 | P4/nmm (129) | ✔ | 18 | 156 | 3 | 1.3301 | 1.661 | 0.000 | (0;000) | ✗ | 30/01/17 |
NaAuO2 | COD | 8101055 | Cmcm (63) | ✔ | 8 | 64 | 0 | 1.5095 | 2.066 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ga2S3 | COD | 8101056 | Cc (9) | ✗ | 10 | 88 | 3 | 1.8887 | 1.889 | 0.000 | (0;000) | ✗ | 22/03/17 |
Ta2C | COD | 8101059 | P-3m1 (164) | ✔ | 3 | 30 | 3 | 0.0 | 0.355 | 0.178 | (1;000) | ✗ | 27/01/17 |
RbAuO | COD | 8101135 | I4/mmm (139) | ✔ | 12 | 104 | 0 | 0.0 | 0.004 | 0.611 | (1;000) | ✗ | 02/02/17 |
Ca(AlGe)2 | COD | 8101147 | P-3m1 (164) | ✔ | 5 | 24 | 2 | 0.0 | 0.134 | 0.202 | (0;000) | ✗ | 05/01/17 |
BaLi2(MgSi)2 | COD | 8101152 | R-3m (166) | ✔ | 7 | 44 | 1 | 0.0 | 0.311 | 0.196 | (0;000) | ✗ | 05/01/17 |
BaLi2(MgGe)2 | COD | 8101153 | R-3m (166) | ✔ | 7 | 44 | 1 | 0.0 | 0.117 | 0.220 | (0;000) | ✗ | 05/01/17 |
In2Si2O7 | COD | 8101227 | C2/m (12) | ✔ | 11 | 76 | 3 | 3.1038 | 3.104 | 0.000 | (0;000) | ✗ | 27/01/17 |
CrCoGe | COD | 8101260 | P6_3/mmc (194) | ✔ | 6 | 70 | 3 | 0.0 | 0.000 | 0.845 | (1;000) | ✗ | 27/01/17 |
K2SnTe3 | COD | 8101316 | Cmce (64) | ✔ | 24 | 200 | 1 | 0.8357 | 0.844 | 0.000 | (0;000) | ✗ | 04/08/17 |
GaSeBr7 | COD | 8101317 | Pc (7) | ✗ | 18 | 136 | 1 | 2.2271 | 2.259 | 0.000 | (0;000) | ✗ | 21/03/17 |
Hg(AsO3)2 | COD | 8101392 | P-31m (162) | ✔ | 9 | 58 | 3 | 0.9726 | 1.700 | 0.000 | (0;000) | ✗ | 05/01/17 |
Zr5Te4 | COD | 8101423 | I4/m (87) | ✔ | 9 | 44 | 3 | 0.0 | 0.001 | 0.690 | (1;111) | ✗ | 02/02/17 |
Sr5Ge3 | COD | 8101451 | I4/mcm (140) | ✔ | 16 | 124 | 1 | 0.0 | 0.002 | 0.636 | (1;000) | ✗ | 02/02/17 |
Sr5Si3 | COD | 8101453 | I4/mcm (140) | ✔ | 16 | 124 | 1 | 0.0 | 0.011 | 0.586 | (0;000) | ✗ | 02/02/17 |
Sn2OF5 | COD | 8101512 | C2/m (12) | ✔ | 16 | 138 | 3 | 2.3848 | 2.974 | 0.000 | (0;000) | ✗ | 02/02/17 |
KHfCuS3 | COD | 8101656 | Cmcm (63) | ✔ | 12 | 100 | 1 | 0.8118 | 0.821 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2ZrSe3 | COD | 8101657 | Cmcm (63) | ✔ | 12 | 80 | 1 | 1.2811 | 1.281 | 0.000 | (0;000) | ✗ | 02/02/17 |
Bi3ClO4 | COD | 8101670 | C2/c (15) | ✔ | 16 | 152 | 2 | 2.3289 | 2.362 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2MoCl6 | COD | 8102884 | Fm-3m (225) | ✔ | 9 | 74 | 1 | 0.0 | 0.000 | 0.190 | (0;000) | ✗ | 02/02/17 |
BaSeO4 | COD | 8102886 | Pnma (62) | ✔ | 24 | 160 | 1 | 4.5065 | 4.555 | 0.000 | (0;000) | ✗ | 04/08/17 |
Cs2SiSe4 | COD | 8102891 | C2/m (12) | ✔ | 14 | 92 | 1 | 2.0342 | 2.048 | 0.000 | (0;000) | ✗ | 02/02/17 |
Mg3Pd | COD | 8102899 | P6_3cm (185) | ✗ | 24 | 288 | 3 | 0.0 | 0.000 | 0.732 | ? | ✗ | 04/08/17 |
VCoSi | COD | 8102916 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.001 | 0.147 | (0;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 |
Sr2I2O | COD | 8102957 | Ibam (72) | ✔ | 10 | 80 | 1 | 3.1001 | 3.225 | 0.000 | (0;000) | ✗ | 02/02/17 |
HfGaPd | COD | 8102958 | P-62c (190) | ✗ | 18 | 258 | 3 | 0.0 | 0.000 | 0.436 | ? | ✗ | 22/03/17 |
NbBr5 | COD | 8102968 | P-1 (2) | ✔ | 12 | 96 | 1 | 0.1832 | 0.196 | 0.000 | (0;000) | ✗ | 02/02/17 |
K4ZnAs2 | COD | 8102969 | R-3m (166) | ✔ | 7 | 58 | 1 | 0.7611 | 0.761 | 0.000 | (0;000) | ✗ | 30/01/17 |
NaSi | COD | 8102990 | C2/c (15) | ✔ | 16 | 104 | 1 | 1.1134 | 1.225 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaSi6 | COD | 8103027 | Cmcm (63) | ✔ | 14 | 68 | 3 | 0.0 | 0.004 | 0.931 | (0;110) | ✗ | 02/02/17 |
ZrSiPt | COD | 8103045 | Pnma (62) | ✔ | 12 | 72 | 3 | 0.0 | 0.030 | 0.081 | (1;000) | ✗ | 27/01/17 |
ZrGePt | COD | 8103046 | Pnma (62) | ✔ | 12 | 72 | 3 | 0.0 | 0.038 | 0.071 | (1;000) | ✗ | 02/02/17 |
CrPb2O5 | COD | 8103050 | C2/m (12) | ✔ | 16 | 144 | 3 | 1.8045 | 2.012 | 0.000 | (0;000) | ✗ | 02/02/17 |
GaPd | COD | 8103055 | P2_13 (198) | ✗ | 8 | 124 | 3 | 0.0 | 0.000 | 0.518 | ? | ✗ | 15/02/17 |
Na2SrSn4 | COD | 8103057 | C2/c (15) | ✔ | 14 | 168 | 1 | 0.0 | 0.036 | 0.351 | (0;000) | ✗ | 02/02/17 |
CaGa2Ni | COD | 8103269 | Cmcm (63) | ✔ | 8 | 92 | 3 | 0.0 | 0.006 | 0.691 | (1;000) | ✗ | 27/01/17 |
AgPb2Br5 | COD | 8103387 | C2/c (15) | ✔ | 16 | 148 | 3 | 1.3513 | 1.385 | 0.000 | (0;000) | ✗ | 30/01/17 |
AgClO3 | COD | 8103389 | I4/m (87) | ✔ | 20 | 144 | 3 | 3.0144 | 3.202 | 0.000 | (0;000) | ✗ | 30/01/17 |
CuAgS | COD | 8103391 | Cmcm (63) | ✔ | 6 | 56 | 3 | 0.4708 | 0.549 | 0.000 | (0;000) | ✗ | 05/01/17 |
K2AgP | COD | 8103396 | Cmcm (63) | ✔ | 8 | 68 | 1 | 1.1954 | 1.279 | 0.000 | (0;000) | ✗ | 30/01/17 |
MnAgO4 | COD | 8103397 | P2_1/c (14) | ✔ | 24 | 200 | 3 | 0.7334 | 0.762 | 0.000 | (0;000) | ✗ | 04/08/17 |
AgN | COD | 8103398 | Cmce (64) | ✔ | 8 | 64 | 1 | 0.0 | 0.001 | 0.419 | (1;000) | ✗ | 30/01/17 |
Ag3AsSe3 | COD | 8103405 | R3c (161) | ✗ | 14 | 112 | 3 | 0.7517 | 1.200 | 0.000 | (0;000) | ✗ | 16/03/17 |
KAg3Se2 | COD | 8103421 | C2/m (12) | ✔ | 12 | 108 | 1 | 0.0 | 0.023 | 0.017 | (0;000) | ✗ | 30/01/17 |
KAg3Te2 | COD | 8103422 | C2/m (12) | ✔ | 12 | 108 | 3 | 0.0 | 0.042 | 0.025 | (1;000) | ✗ | 30/01/17 |
RbAuCl4 | COD | 8103425 | C2/c (15) | ✔ | 12 | 96 | 1 | 2.0009 | 2.007 | 0.000 | (0;000) | ✗ | 30/01/17 |
K3AuSe2 | COD | 8103427 | R-3c (167) | ✔ | 12 | 100 | 1 | 2.0665 | 2.145 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbAuSe | COD | 8103428 | Cmcm (63) | ✔ | 6 | 52 | 1 | 1.6696 | 1.949 | 0.000 | (0;000) | ✗ | 05/01/17 |
RbAuBr4 | COD | 8103439 | P2_1/c (14) | ✔ | 12 | 96 | 1 | 1.5384 | 1.564 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ca3Ni7B2 | COD | 8103447 | R-3m (166) | ✔ | 12 | 106 | 3 | 0.0 | 0.005 | 0.372 | (0;000) | ✗ | 05/01/17 |
Cs3BP2 | COD | 8103455 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.8676 | 1.908 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlBF4 | COD | 8103456 | Pnma (62) | ✔ | 24 | 176 | 1 | 5.4599 | 5.598 | 0.000 | (0;000) | ✗ | 04/08/17 |
K3BP2 | COD | 8103458 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.6994 | 2.098 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3BP2 | COD | 8103467 | P2_1/c (14) | ✔ | 24 | 160 | 1 | 1.861 | 2.075 | 0.000 | (0;000) | ✗ | 04/08/17 |
TiBO3 | COD | 8103469 | R-3c (167) | ✔ | 10 | 66 | 3 | 0.0 | 0.000 | 0.815 | (0;000) | ✗ | 27/01/17 |
BPO4 | COD | 8103470 | P3_121 (152) | ✗ | 18 | 96 | 3 | 7.469 | 7.603 | 0.000 | (0;000) | ✗ | 15/02/17 |
Rb3BP2 | COD | 8103471 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.6726 | 2.002 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaNi4B | COD | 8103479 | P6/mmm (191) | ✔ | 12 | 106 | 3 | 0.0 | 0.001 | 0.746 | (1;000) | ✗ | 05/01/17 |
YB4 | COD | 8103481 | P4/mbm (127) | ✔ | 20 | 92 | 3 | 0.0 | 0.002 | 0.218 | (1;001) | ✗ | 02/02/17 |
Ba(Ni2B)6 | COD | 8103483 | R-3m (166) | ✔ | 19 | 148 | 3 | 0.0 | 0.000 | 0.748 | (1;111) | ✗ | 02/02/17 |
Ca(Ni2B)6 | COD | 8103487 | R-3m (166) | ✔ | 19 | 148 | 3 | 0.0 | 0.003 | 0.766 | (1;111) | ✗ | 05/01/17 |
Sr(Ni2B)6 | COD | 8103490 | R-3m (166) | ✔ | 19 | 148 | 3 | 0.0 | 0.001 | 0.724 | (0;000) | ✗ | 05/01/17 |
CdI2 | COD | 8103504 | P3m1 (156) | ✗ | 21 | 182 | 1 | 1.9491 | 2.170 | 0.000 | (0;000) | ✗ | 07/08/17 |
CdI2 | COD | 8103505 | P-3m1 (164) | ✔ | 24 | 208 | 1 | 1.8942 | 2.124 | 0.000 | (0;000) | ✗ | 04/08/17 |
Tl4GeS4 | COD | 8103540 | Cc (9) | ✗ | 18 | 160 | 3 | 2.5167 | 0.018 | 1.000 | (0;000) | ✗ | 22/03/17 |
Tl3SbS4 | COD | 8103549 | P1 (1) | ✗ | 16 | 136 | 1 | 0.0 | 0.058 | 1.000 | ? | ✗ | 29/03/17 |
K2ZnF4 | COD | 8103552 | I4/mmm (139) | ✔ | 7 | 58 | 2 | 4.3258 | 5.758 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaAsS2 | COD | 8103561 | P2_1/c (14) | ✔ | 16 | 104 | 1 | 1.4835 | 1.565 | 0.000 | (0;000) | ✗ | 30/01/17 |
CsSrN9 | COD | 8103571 | C2/c (15) | ✔ | 22 | 128 | 1 | 3.8586 | 3.952 | 0.000 | (0;000) | ✗ | 07/08/17 |
GeBr2 | COD | 8103585 | P2_1/c (14) | ✔ | 24 | 144 | 2 | 2.608 | 2.634 | 0.000 | (0;000) | ✗ | 04/08/17 |
Pb3SO6 | COD | 8103588 | P2_1/m (11) | ✔ | 20 | 168 | 3 | 2.7642 | 2.875 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiSCl | COD | 8103601 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.2731 | 1.362 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiBr3 | COD | 8103605 | P2_1/c (14) | ✔ | 16 | 144 | 2 | 2.133 | 2.198 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiBr3 | COD | 8103606 | C2/m (12) | ✔ | 8 | 72 | 2 | 2.0253 | 2.057 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaGe2O5 | COD | 8103645 | P-1 (2) | ✔ | 16 | 96 | 3 | 2.9045 | 2.938 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaN6 | COD | 8103674 | P2_1/m (11) | ✔ | 14 | 80 | 1 | 3.9887 | 3.989 | 0.000 | (0;000) | ✗ | 02/02/17 |
MgCl2 | COD | 8103685 | P-3m1 (164) | ✔ | 3 | 24 | 2 | 5.5256 | 5.526 | 0.000 | (0;000) | ✗ | 27/01/17 |