▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NbTe4 | COD | 2101236 | P4/mcc (124) | ✔ | 10 | 74 | 1 | 0.0 | 0.000 | 0.474 | (1;110) | ✗ | 02/02/17 |
Ti4Bi2O11 | COD | 2101260 | C2/m (12) | ✔ | 17 | 144 | 3 | 2.0813 | 2.516 | 0.000 | (0;000) | ✗ | 21/03/17 |
H12C5O4 | COD | 2101361 | I-4 (82) | ✗ | 21 | 56 | 1 | 5.6597 | 5.684 | 0.000 | (0;000) | ✗ | 04/08/17 |
YFeO3 | COD | 2101386 | Pnma (62) | ✔ | 20 | 148 | 3 | 0.0 | 0.001 | 0.419 | (0;110) | ✗ | 02/02/17 |
Bi2Rh | COD | 2101560 | P-1 (2) | ✔ | 12 | 188 | 3 | 0.0 | 0.214 | 0.033 | (0;001) | ✗ | 02/02/17 |
BaBiO3 | COD | 2101573 | Pba2 (32) | ✗ | 20 | 172 | 3 | 0.0 | 0.079 | 0.415 | ? | ✗ | 21/03/17 |
S2N | COD | 2101578 | P4_2nm (102) | ✗ | 24 | 136 | 1 | 1.4175 | 1.598 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba(GeAs)2 | COD | 2101579 | P4_2mc (105) | ✗ | 20 | 112 | 3 | 0.034 | 0.116 | 0.000 | (0;000) | ✔ | 26/04/17 |
Sr2MnSbO6 | COD | 2101591 | I4mm (107) | ✗ | 10 | 76 | 3 | 0.0 | 0.011 | 0.791 | ? | ✗ | 15/02/17 |
KNa2CuO2 | COD | 2101592 | I4mm (107) | ✗ | 6 | 50 | 1 | 1.595 | 1.886 | 0.000 | (0;000) | ✗ | 15/02/17 |
KLiSi2O5 | COD | 2101610 | P2_1 (4) | ✗ | 18 | 100 | 3 | 4.9846 | 5.054 | 0.000 | (0;000) | ✗ | 29/03/17 |
ZnWO4 | COD | 2101675 | P2/c (13) | ✔ | 12 | 128 | 3 | 2.9526 | 2.975 | 0.000 | (0;000) | ✗ | 11/04/17 |
ZnWO4 | COD | 2101686 | P-1 (2) | ✔ | 12 | 128 | 3 | 2.6316 | 2.818 | 0.000 | (0;000) | ✗ | 11/04/17 |
NaSbF6 | COD | 2101697 | Fm-3m (225) | ✔ | 8 | 56 | 1 | 5.8791 | 5.879 | 0.000 | (0;000) | ✗ | 27/01/17 |
VSbO4 | COD | 2101705 | I4_1md (109) | ✗ | 12 | 84 | 3 | 0.0 | 0.004 | 1.000 | ? | ✗ | 15/02/17 |
YTiO3 | COD | 2101924 | Pnma (62) | ✔ | 20 | 164 | 3 | 0.0 | 0.001 | 0.698 | (0;110) | ✗ | 02/02/17 |
Fe2O | COD | 2101926 | P4mm (99) | ✗ | 3 | 22 | 1 | 0.0 | 0.000 | 0.526 | ? | ✗ | 22/03/17 |
MoCl5 | COD | 2101942 | P-1 (2) | ✔ | 12 | 98 | 1 | 0.0 | 0.004 | 0.377 | (1;111) | ✗ | 02/02/17 |
Cu6PbO8 | COD | 2102004 | Fm-3m (225) | ✔ | 15 | 128 | 3 | 0.0 | 0.006 | 0.271 | (0;000) | ✗ | 02/02/17 |
Cu6PbO8 | COD | 2102005 | Fm-3m (225) | ✔ | 15 | 128 | 3 | 0.0 | 0.006 | 0.540 | (0;000) | ✗ | 27/01/17 |
ZrP2O7 | COD | 2102118 | Pnnm (58) | ✔ | 20 | 112 | 3 | 4.355 | 4.355 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ta2O5 | COD | 2102123 | C2/c (15) | ✔ | 14 | 112 | 3 | 3.6486 | 3.867 | 0.000 | (0;000) | ✗ | 27/01/17 |
P2Pb3O8 | COD | 2102273 | R-3m (166) | ✔ | 13 | 100 | 1 | 3.1324 | 3.247 | 0.000 | (0;000) | ✗ | 27/01/17 |
PtCCl2O | COD | 2102529 | P4_2/m (84) | ✔ | 20 | 136 | 2 | 1.4271 | 1.435 | 0.000 | (0;000) | ✗ | 02/02/17 |
V2O5 | COD | 2102583 | P2_1/m (11) | ✔ | 14 | 112 | 2 | 1.6128 | 1.826 | 0.000 | (0;000) | ✗ | 27/01/17 |
CrF3 | COD | 2102656 | R-3c (167) | ✔ | 8 | 70 | 3 | 0.0 | 0.000 | 0.416 | (0;000) | ✗ | 27/01/17 |
MgH4(CO)2 | COD | 2102790 | C2/m (12) | ✔ | 9 | 34 | 1 | 0.0 | 0.004 | 0.546 | (0;000) | ✗ | 27/01/17 |
CsAs3O8 | COD | 2102799 | C2/c (15) | ✔ | 24 | 144 | 3 | 2.8495 | 2.850 | 0.000 | (0;000) | ✗ | 04/08/17 |
H2C4O5 | COD | 2102818 | C2/c (15) | ✔ | 22 | 96 | 1 | 0.0 | 0.003 | 0.172 | (0;000) | ✗ | 04/08/17 |
NaTaGeO5 | COD | 2102920 | C2/c (15) | ✔ | 16 | 112 | 3 | 3.5172 | 3.518 | 0.000 | (0;000) | ✗ | 02/02/17 |
C4SBr4 | COD | 2102931 | Pc (7) | ✗ | 18 | 100 | 1 | 2.3353 | 2.485 | 0.000 | (0;000) | ✗ | 21/03/17 |
MgH4(ClO)2 | COD | 2103098 | C2/m (12) | ✔ | 9 | 40 | 2 | 5.5706 | 5.571 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeH2SO5 | COD | 2103101 | C2/c (15) | ✔ | 18 | 92 | 3 | 0.3254 | 0.359 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiTaGeO5 | COD | 2103314 | C2/c (15) | ✔ | 16 | 100 | 3 | 3.8933 | 3.893 | 0.000 | (0;000) | ✗ | 02/02/17 |
HgI2 | COD | 2103470 | P4_2/nmc (137) | ✔ | 24 | 208 | 3 | 1.0894 | 1.089 | 0.000 | (0;000) | ✗ | 04/08/17 |
H3C2N | COD | 2103498 | P2_1/c (14) | ✔ | 24 | 64 | 1 | 7.2294 | 7.259 | 0.000 | (0;000) | ✗ | 04/08/17 |
Zr(MoO4)2 | COD | 2103589 | C2/m (12) | ✔ | 11 | 80 | 3 | 2.6175 | 2.799 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaCl | COD | 2104025 | Pm-3m (221) | ✔ | 2 | 16 | 3 | 4.381 | 4.381 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaTi(SiO3)2 | COD | 2104036 | C2/c (15) | ✔ | 20 | 130 | 3 | 0.0 | 0.000 | 0.941 | (0;101) | ✗ | 02/02/17 |
SnS5N2 | COD | 2104053 | Pbam (55) | ✔ | 16 | 108 | 3 | 0.0 | 0.004 | 0.443 | (1;100) | ✗ | 02/02/17 |
Bi10Mo3 | COD | 2104405 | C2/m (12) | ✔ | 13 | 192 | 1 | 0.0 | 0.007 | 0.526 | (1;000) | ✗ | 21/03/17 |
Bi3Mo | COD | 2104406 | P2_1/m (11) | ✔ | 16 | 236 | 1 | 0.0 | 0.008 | 0.509 | (1;000) | ✗ | 02/02/17 |
Bi14Mo5 | COD | 2104407 | C2/m (12) | ✔ | 19 | 280 | 1 | 0.0 | 0.005 | 0.650 | (0;001) | ✗ | 21/03/17 |
NO2 | COD | 2104473 | Im3 (204) | ✔ | 18 | 102 | 1 | 2.8252 | 2.825 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr2CaWO6 | COD | 2104688 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 3.3236 | 3.434 | 0.000 | (0;000) | ✗ | 02/02/17 |
MgH4(ClO5)2 | COD | 2104833 | C2/m (12) | ✔ | 17 | 88 | 2 | 3.083 | 3.109 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mn2As2O7 | COD | 2104871 | C2/m (12) | ✔ | 11 | 82 | 3 | 0.0 | 0.019 | 0.267 | (0;110) | ✗ | 05/01/17 |
Rb2S | COD | 2104951 | P6_3/mmc (194) | ✔ | 6 | 48 | 1 | 2.7069 | 2.707 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2S | COD | 2104952 | Pnma (62) | ✔ | 12 | 96 | 1 | 2.0772 | 2.086 | 0.000 | (0;000) | ✗ | 02/02/17 |
KAlO2 | COD | 2105208 | Fd-3m (227) | ✔ | 8 | 48 | 0 | 3.2866 | 3.290 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaAg | COD | 2105337 | Pnma (62) | ✔ | 8 | 84 | 2 | 0.0 | 0.002 | 0.417 | (1;011) | ✗ | 30/01/17 |
FeAgO2 | COD | 2105341 | P6_3/mmc (194) | ✔ | 8 | 62 | 3 | 0.0 | 0.003 | 0.665 | (0;000) | ✗ | 05/01/17 |
AgI | COD | 2105342 | P6_3mc (186) | ✗ | 8 | 72 | 2 | 0.7513 | 0.751 | 0.000 | (0;000) | ✗ | 16/03/17 |
K2AgI3 | COD | 2105343 | Pnma (62) | ✔ | 24 | 200 | 1 | 2.4092 | 2.409 | 0.000 | (0;000) | ✗ | 04/08/17 |
AgPS3 | COD | 2105351 | C2/m (12) | ✔ | 10 | 68 | 3 | 1.3659 | 1.686 | 0.000 | (0;000) | ✗ | 30/01/17 |
SrAg | COD | 2105352 | Pnma (62) | ✔ | 16 | 168 | 1 | 0.0 | 0.002 | 0.669 | (0;000) | ✗ | 16/03/17 |
Ag8S | COD | 2105382 | Imm2 (44) | ✗ | 9 | 94 | 3 | 0.0 | 0.003 | 0.259 | (1;100) | ✔ | 26/04/17 |
TlAg3Te2 | COD | 2105385 | Cmmm (65) | ✔ | 6 | 58 | 3 | 0.0 | 0.086 | 0.463 | (1;000) | ✗ | 05/01/17 |
AuClO | COD | 2105387 | R-3 (148) | ✔ | 18 | 144 | 3 | 1.1439 | 1.248 | 0.000 | (0;000) | ✗ | 30/01/17 |
Au2O3 | COD | 2105390 | Fdd2 (43) | ✗ | 10 | 80 | 3 | 1.0569 | 1.226 | 0.000 | (0;000) | ✗ | 15/02/17 |
P3Au2 | COD | 2105391 | C2/m (12) | ✔ | 10 | 74 | 3 | 0.0 | 0.091 | 0.119 | (1;001) | ✗ | 05/01/17 |
Y3Sb4Au3 | COD | 2105392 | I-43d (220) | ✗ | 20 | 172 | 3 | 0.5301 | 0.673 | 0.000 | (0;000) | ✗ | 21/03/17 |
B2O3 | COD | 2105403 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 8.6954 | 8.982 | 0.000 | (0;000) | ✗ | 15/02/17 |
HfB4Ir3 | COD | 2105436 | P6_3/m (176) | ✔ | 16 | 150 | 3 | 0.0 | 0.000 | 0.587 | (0;000) | ✗ | 05/01/17 |
K2PtCl6 | COD | 2105522 | Fm-3m (225) | ✔ | 9 | 70 | 1 | 1.611 | 1.611 | 0.000 | (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 |
SiBr4 | COD | 2105707 | P2_1/c (14) | ✔ | 20 | 128 | 1 | 4.2129 | 4.288 | 0.000 | (0;000) | ✗ | 02/02/17 |
KYS2 | COD | 2105803 | R-3m (166) | ✔ | 4 | 32 | 2 | 2.2739 | 2.974 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbYS2 | COD | 2105804 | R-3m (166) | ✔ | 4 | 32 | 2 | 2.2654 | 2.916 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2SiF6 | COD | 2106022 | Fm-3m (225) | ✔ | 9 | 64 | 1 | 7.4869 | 7.487 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeSi2 | COD | 2106045 | Cmce (64) | ✔ | 24 | 128 | 3 | 0.7214 | 0.791 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlSeCl7 | COD | 2106066 | P1 (1) | ✗ | 18 | 116 | 1 | 0.0 | 0.028 | 0.737 | ? | ✗ | 16/03/17 |
Sc2Pt | COD | 2106085 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.015 | 0.299 | (0;000) | ✗ | 02/02/17 |
MoP4 | COD | 2106092 | C2/c (15) | ✔ | 10 | 68 | 2 | 0.0 | 0.019 | 0.126 | (1;000) | ✗ | 27/01/17 |
YNi | COD | 2106095 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.002 | 0.524 | (1;011) | ✗ | 27/01/17 |
MgNi2 | COD | 2106100 | P6_3/mmc (194) | ✔ | 24 | 240 | 3 | 0.0 | 0.005 | 0.765 | (1;000) | ✗ | 04/08/17 |
RbGa7 | COD | 2106106 | R-3m (166) | ✔ | 16 | 200 | 3 | 0.0 | 0.011 | 0.408 | (1;111) | ✗ | 02/02/17 |
Zr3Cd2 | COD | 2106134 | Pmmm (47) | ✔ | 5 | 36 | 2 | 0.0 | 0.003 | 0.647 | (1;001) | ✗ | 02/02/17 |
ZrCd3 | COD | 2106135 | P4/mmm (123) | ✔ | 4 | 40 | 3 | 0.0 | 0.000 | 0.628 | (1;111) | ✗ | 27/01/17 |
LiH3O2 | COD | 2106174 | C2/m (12) | ✔ | 12 | 36 | 1 | 3.8048 | 3.883 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsI | COD | 2106199 | P4/mmm (123) | ✔ | 2 | 16 | 3 | 0.0 | 0.000 | 0.705 | (0;000) | ✗ | 22/12/16 |
Na2MnCl4 | COD | 2106200 | Pbam (55) | ✔ | 14 | 122 | 1 | 0.0 | 0.000 | 0.664 | (0;000) | ✗ | 02/02/17 |
PCl3O | COD | 2106202 | Pna2_1 (33) | ✗ | 20 | 128 | 1 | 4.6695 | 4.670 | 0.000 | (0;000) | ✗ | 22/03/17 |
CdI2 | COD | 2106203 | P3m1 (156) | ✗ | 21 | 182 | 1 | 1.9772 | 2.174 | 0.000 | (0;000) | ✗ | 07/08/17 |
CdI2 | COD | 2106204 | P3m1 (156) | ✗ | 24 | 208 | 1 | 1.9332 | 2.153 | 0.000 | (0;000) | ✗ | 04/08/17 |
PBr3O | COD | 2106216 | Pnma (62) | ✔ | 20 | 128 | 1 | 3.3896 | 3.488 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na2S | COD | 2106220 | Pnma (62) | ✔ | 12 | 96 | 1 | 2.6588 | 2.659 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na2S | COD | 2106221 | P6_3/mmc (194) | ✔ | 6 | 48 | 1 | 2.4792 | 2.479 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaBrO3 | COD | 2106225 | P2_13 (198) | ✗ | 20 | 136 | 1 | 4.8193 | 4.821 | 0.000 | (0;000) | ✗ | 21/03/17 |
ScSi7Rh3 | COD | 2106276 | R-3c (167) | ✔ | 22 | 180 | 3 | 0.0 | 0.001 | 0.289 | (1;000) | ✗ | 07/08/17 |
ScSi2Rh | COD | 2106278 | Pnma (62) | ✔ | 16 | 144 | 3 | 0.0 | 0.027 | 0.241 | (1;000) | ✗ | 02/02/17 |
MgAs4 | COD | 2106317 | P4_12_12 (92) | ✗ | 20 | 120 | 3 | 0.836 | 0.848 | 0.000 | (0;000) | ✗ | 21/03/17 |
NaIO4 | COD | 2106357 | I4_1/a (88) | ✔ | 12 | 80 | 1 | 2.3682 | 2.392 | 0.000 | (0;000) | ✗ | 30/01/17 |
Na2SeO4 | COD | 2106359 | Fddd (70) | ✔ | 14 | 96 | 1 | 3.7333 | 3.772 | 0.000 | (0;000) | ✗ | 27/01/17 |
Cs3Bi2Br9 | COD | 2106376 | P-3m1 (164) | ✔ | 14 | 120 | 2 | 1.7199 | 1.866 | 0.000 | (0;000) | ✗ | 02/02/17 |
YOF | COD | 2106385 | R-3m (166) | ✔ | 6 | 48 | 3 | 4.9065 | 4.907 | 0.000 | (0;000) | ✗ | 27/01/17 |
K4SnO4 | COD | 2106386 | P-1 (2) | ✔ | 18 | 148 | 1 | 2.5879 | 2.661 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaCO3 | COD | 2106394 | P2_1/c (14) | ✔ | 20 | 128 | 1 | 4.9865 | 5.058 | 0.000 | (0;000) | ✗ | 02/02/17 |
YZn3 | COD | 2106397 | Pnma (62) | ✔ | 16 | 188 | 3 | 0.0 | 0.000 | 0.763 | (1;011) | ✗ | 02/02/17 |
H4NF | COD | 2106401 | P6_3mc (186) | ✗ | 12 | 32 | 1 | 5.8885 | 5.974 | 0.000 | (0;000) | ✗ | 15/02/17 |