▹ Formula | ▹ Source | ▹ ID | ▴ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Bi8Se9 | ICSD | 42665 | R-3m (166) | ✔ | 17 | 94 | 2 | 0.0 | 0.024 | 0.183 | (0;111) | ✗ | 06/10/16 |
AlTlO2 | ICSD | 29010 | R-3m (166) | ✔ | 8 | 56 | 3 | 1.3755 | 1.384 | 0.000 | (0;000) | ✗ | 05/01/17 |
Bi8Te9 | ICSD | 106330 | R-3m (166) | ✔ | 17 | 94 | 1 | 0.0 | 0.033 | 0.669 | (0;111) | ✗ | 06/10/16 |
K3Sb2Au3 | COD | 1510504 | R-3m (166) | ✔ | 8 | 70 | 2 | 0.7493 | 0.749 | 0.000 | (0;000) | ✗ | 30/01/17 |
K4HgP2 | ICSD | 67263 | R-3m (166) | ✔ | 7 | 58 | 1 | 1.021 | 1.064 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba(Cu2As)2 | COD | 1521018 | R-3m (166) | ✔ | 7 | 64 | 2 | 0.0 | 0.006 | 0.401 | (1;000) | ✗ | 05/01/17 |
NiTe | ICSD | 76730 | R-3m (166) | ✔ | 4 | 32 | 2 | 0.0 | 0.007 | 0.863 | (0;000) | ✗ | 27/01/17 |
Cs2NaAl3F12 | COD | 1000492 | R-3m (166) | ✔ | 18 | 120 | 1 | 7.3545 | 7.371 | 0.000 | (0;000) | ✗ | 30/01/17 |
K2Pb(SO4)2 | COD | 9012718 | R-3m (166) | ✔ | 13 | 92 | 1 | 3.8802 | 4.111 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb3Sb2Au3 | COD | 1510512 | R-3m (166) | ✔ | 8 | 70 | 2 | 1.0302 | 1.161 | 0.000 | (0;000) | ✗ | 30/01/17 |
WN2 | ICSD | 30364 | R-3m (166) | ✔ | 3 | 24 | 2 | 0.0 | 0.002 | 0.186 | (1;000) | ✗ | 27/01/17 |
Ca(Cu2As)2 | ICSD | 32619 | R-3m (166) | ✔ | 7 | 64 | 2 | 0.0 | 0.006 | 0.438 | (1;000) | ✗ | 05/01/17 |
Ca(GaAs)2 | ICSD | 422526 | R-3m (166) | ✔ | 5 | 46 | 2 | 0.0 | 0.082 | 0.050 | (1;111) | ✗ | 05/01/17 |
YTlS2 | ICSD | 651267 | R-3m (166) | ✔ | 4 | 36 | 2 | 1.4802 | 2.223 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiScS2 | ICSD | 642305 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.5243 | 2.409 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr(NiO2)4 | ICSD | 40469 | R-3m (166) | ✔ | 13 | 98 | 2 | 0.0 | 0.001 | 0.809 | (1;111) | ✗ | 27/01/17 |
Sb2Te2Se | COD | 9007591 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.3356 | 0.346 | 0.000 | (1;000) | ✗ | 27/01/17 |
ZnCl2 | COD | 9009136 | R-3m (166) | ✔ | 3 | 26 | 2 | 3.1235 | 3.189 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sb2Te3 | COD | 9007590 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.1121 | 0.227 | 0.000 | (1;000) | ✗ | 27/01/17 |
LiYSe2 | ICSD | 44963 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.0914 | 2.359 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sb2TeSe2 | ICSD | 651529 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.0656 | 0.066 | 0.000 | (1;000) | ✗ | 27/01/17 |
LiYS2 | ICSD | 44957 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.6757 | 2.755 | 0.000 | (0;000) | ✗ | 27/01/17 |
K3Cu3As2 | ICSD | 32015 | R-3m (166) | ✔ | 8 | 70 | 2 | 1.2339 | 1.286 | 0.000 | (0;000) | ✗ | 05/01/17 |
Sr(Cu2As)2 | COD | 1521016 | R-3m (166) | ✔ | 7 | 64 | 2 | 0.0 | 0.011 | 0.421 | (1;000) | ✗ | 05/01/17 |
Ge(Te2As)2 | ICSD | 68111 | R-3m (166) | ✔ | 7 | 38 | 2 | 0.1064 | 0.136 | 0.000 | (0;000) | ✗ | 05/01/17 |
V3Sb2 | ICSD | 41814 | R-3m (166) | ✔ | 10 | 98 | 3 | 0.0 | 0.014 | 0.367 | (0;000) | ✗ | 27/01/17 |
Sb | COD | 9008575 | R-3m (166) | ✔ | 2 | 10 | 3 | 0.0 | 0.081 | 0.025 | (1;111) | ✗ | 27/01/17 |
Mg2SiNi3 | ICSD | 44926 | R-3m (166) | ✔ | 6 | 54 | 3 | 0.0 | 0.028 | 0.204 | (1;111) | ✗ | 27/01/17 |
Sr(SnAs)2 | COD | 1008735 | R-3m (166) | ✔ | 5 | 48 | 2 | 0.0 | 0.091 | 0.028 | (1;000) | ✗ | 05/01/17 |
Te3As2 | ICSD | 68110 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.0 | 0.077 | 0.045 | (1;000) | ✗ | 05/01/17 |
RbYS2 | COD | 2105804 | R-3m (166) | ✔ | 4 | 32 | 2 | 2.2654 | 2.916 | 0.000 | (0;000) | ✗ | 27/01/17 |
B6As | ICSD | 107916 | R-3m (166) | ✔ | 14 | 46 | 3 | 2.5791 | 2.612 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cu2H3ClO3 | COD | 9007603 | R-3m (166) | ✔ | 18 | 100 | 3 | 0.0 | 0.000 | 0.621 | (1;000) | ✗ | 27/01/17 |
CsNiF3 | ICSD | 410393 | R-3m (166) | ✔ | 15 | 120 | 3 | 0.0 | 0.015 | 0.438 | (0;111) | ✗ | 02/02/17 |
RbScS2 | COD | 2020008 | R-3m (166) | ✔ | 4 | 32 | 2 | 1.7063 | 2.455 | 0.000 | (0;000) | ✗ | 27/01/17 |
KAsF6 | COD | 2310606 | R-3m (166) | ✔ | 8 | 56 | 1 | 3.9593 | 3.959 | 0.000 | (0;000) | ✗ | 05/01/17 |
K4ZnAs2 | COD | 8102969 | R-3m (166) | ✔ | 7 | 58 | 1 | 0.7611 | 0.761 | 0.000 | (0;000) | ✗ | 30/01/17 |
Li8Pb3 | ICSD | 15694 | R-3m (166) | ✔ | 11 | 66 | 1 | 0.0 | 0.155 | 0.632 | (1;111) | ✔ | 06/10/16 |
NiI2 | COD | 9009133 | R-3m (166) | ✔ | 3 | 24 | 2 | 0.0 | 0.071 | 0.554 | (0;000) | ✗ | 30/01/17 |
NaRhO2 | ICSD | 66280 | R-3m (166) | ✔ | 4 | 38 | 2 | 1.4316 | 1.523 | 0.000 | (0;000) | ✗ | 27/01/17 |
PbI2 | COD | 9009142 | R-3m (166) | ✔ | 3 | 28 | 2 | 1.436 | 1.436 | 0.000 | (0;000) | ✗ | 30/01/17 |
ZnI2 | COD | 9009137 | R-3m (166) | ✔ | 3 | 26 | 2 | 1.1064 | 1.334 | 0.000 | (0;000) | ✗ | 30/01/17 |
TlSbTe2 | ICSD | 651642 | R-3m (166) | ✔ | 4 | 30 | 3 | 0.0 | 0.106 | 0.018 | (1;000) | ✗ | 27/01/17 |
As | COD | 9008574 | R-3m (166) | ✔ | 2 | 10 | 2 | 0.0 | 0.074 | 0.060 | (1;111) | ✗ | 05/01/17 |
K2LiAlH6 | ICSD | 245318 | R-3m (166) | ✔ | 20 | 60 | 1 | 2.586 | 2.909 | 0.000 | (0;000) | ✗ | 30/01/17 |
SbAs | COD | 9001315 | R-3m (166) | ✔ | 2 | 10 | 3 | 0.0 | 0.157 | 0.276 | (0;000) | ✗ | 05/01/17 |
Fe3S2O15 | COD | 9007285 | R-3m (166) | ✔ | 20 | 126 | 3 | 0.0 | 0.007 | 0.604 | (1;111) | ✗ | 02/02/17 |
ScTlSe2 | ICSD | 418475 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.4619 | 1.083 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2Pb(SO4)2 | ICSD | 29335 | R-3m (166) | ✔ | 13 | 92 | 3 | 0.0 | 0.005 | 0.654 | (0;111) | ✗ | 27/01/17 |
K4CdP2 | ICSD | 61084 | R-3m (166) | ✔ | 7 | 58 | 1 | 0.89 | 0.963 | 0.000 | (0;000) | ✗ | 02/02/17 |
Se | ICSD | 656457 | R-3m (166) | ✔ | 1 | 6 | 3 | 0.0 | 0.028 | 0.777 | (0;000) | ✗ | 27/01/17 |
MgSiN2 | ICSD | 186509 | R-3m (166) | ✔ | 4 | 24 | 3 | 4.2341 | 5.092 | 0.000 | (0;000) | ✗ | 27/01/17 |
KAuF6 | COD | 1510146 | R-3m (166) | ✔ | 8 | 62 | 1 | 2.4134 | 2.413 | 0.000 | (0;000) | ✗ | 05/01/17 |
Sr2IN | COD | 1528373 | R-3m (166) | ✔ | 4 | 32 | 2 | 0.0 | 0.003 | 0.437 | (1;000) | ✗ | 30/01/17 |
CsGa7 | COD | 1525536 | R-3m (166) | ✔ | 16 | 200 | 3 | 0.0 | 0.038 | 0.400 | (1;111) | ✗ | 02/02/17 |
ScHCl | ICSD | 40981 | R-3m (166) | ✔ | 6 | 38 | 2 | 0.0 | 0.011 | 0.232 | (0;111) | ✗ | 27/01/17 |
Cs2NaCoF6 | ICSD | 42157 | R-3m (166) | ✔ | 20 | 172 | 2 | 0.666 | 0.668 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr2IN | COD | 2215222 | R-3m (166) | ✔ | 4 | 32 | 1 | 1.861 | 1.861 | 0.000 | (0;000) | ✗ | 30/01/17 |
BaMg(CO3)2 | ICSD | 193059 | R-3m (166) | ✔ | 10 | 64 | 2 | 4.141 | 4.238 | 0.000 | (0;000) | ✗ | 02/02/17 |
B12S | ICSD | 150626 | R-3m (166) | ✔ | 13 | 42 | 3 | 0.0 | 0.009 | 0.230 | (0;000) | ✗ | 05/01/17 |
HfNCl | ICSD | 261539 | R-3m (166) | ✔ | 6 | 48 | 2 | 2.0932 | 2.412 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2Mg(BO3)2 | ICSD | 75986 | R-3m (166) | ✔ | 11 | 72 | 1 | 4.8916 | 4.892 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ca3Ni7B2 | COD | 8103447 | R-3m (166) | ✔ | 12 | 106 | 3 | 0.0 | 0.005 | 0.372 | (0;000) | ✗ | 05/01/17 |
ZrIN | ICSD | 190381 | R-3m (166) | ✔ | 6 | 32 | 2 | 0.4372 | 1.429 | 0.000 | (0;000) | ✗ | 30/01/17 |
YOF | COD | 2106385 | R-3m (166) | ✔ | 6 | 48 | 3 | 4.9065 | 4.907 | 0.000 | (0;000) | ✗ | 27/01/17 |
Fe3Sn2 | ICSD | 71 | R-3m (166) | ✔ | 10 | 104 | 3 | 0.0 | 0.001 | 0.459 | (1;111) | ✗ | 27/01/17 |
PbI2 | COD | 9009143 | R-3m (166) | ✔ | 6 | 56 | 2 | 1.4443 | 1.444 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsK(ClO4)2 | ICSD | 22504 | R-3m (166) | ✔ | 12 | 80 | 1 | 6.1528 | 6.157 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr4Re2NiO12 | ICSD | 16419 | R-3m (166) | ✔ | 19 | 152 | 1 | 0.0 | 0.029 | 0.040 | (0;000) | ✗ | 02/02/17 |
FeO | ICSD | 82236 | R-3m (166) | ✔ | 2 | 14 | 3 | 0.0 | 0.086 | 0.246 | (0;000) | ✗ | 06/10/16 |
YAl3 | ICSD | 609658 | R-3m (166) | ✔ | 12 | 60 | 3 | 0.0 | 0.007 | 0.516 | (1;000) | ✗ | 30/01/17 |
B2Mo | ICSD | 167732 | R-3m (166) | ✔ | 6 | 40 | 3 | 0.0 | 0.020 | 0.604 | (0;111) | ✗ | 05/01/17 |
ScTlTe2 | ICSD | 418476 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.0 | 0.243 | 0.108 | (0;000) | ✗ | 27/01/17 |
PbI2 | ICSD | 108914 | R-3m (166) | ✔ | 6 | 56 | 1 | 1.4435 | 1.728 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2Sn2O3 | COD | 1527186 | R-3m (166) | ✔ | 7 | 64 | 2 | 0.9774 | 0.977 | 0.000 | (0;000) | ✗ | 27/01/17 |
Os(SCl6)2 | ICSD | 74680 | R-3m (166) | ✔ | 15 | 112 | 1 | 0.386 | 0.445 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3Cu3P2 | COD | 7221376 | R-3m (166) | ✔ | 8 | 70 | 2 | 1.2649 | 1.324 | 0.000 | (0;000) | ✗ | 27/01/17 |
In2Ni3Se2 | ICSD | 640141 | R-3m (166) | ✔ | 7 | 68 | 3 | 0.0 | 0.074 | 0.267 | (0;111) | ✗ | 27/01/17 |
BaNb2V2O11 | ICSD | 165097 | R-3m (166) | ✔ | 16 | 128 | 2 | 2.2681 | 2.270 | 0.000 | (0;000) | ✗ | 02/02/17 |
SiB4 | ICSD | 615435 | R-3m (166) | ✔ | 15 | 48 | 3 | 0.6561 | 1.387 | 0.000 | (0;000) | ✗ | 05/01/17 |
In2Ni3S2 | ICSD | 640134 | R-3m (166) | ✔ | 7 | 68 | 3 | 0.0 | 0.051 | 0.258 | (0;111) | ✗ | 27/01/17 |
Ca(Ni2B)6 | COD | 8103487 | R-3m (166) | ✔ | 19 | 148 | 3 | 0.0 | 0.003 | 0.766 | (1;111) | ✗ | 05/01/17 |
Y4(FeB2)3 | ICSD | 614271 | R-3m (166) | ✔ | 13 | 86 | 3 | 0.0 | 0.010 | 0.699 | (1;000) | ✗ | 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 |
B6O | COD | 1511635 | R-3m (166) | ✔ | 14 | 48 | 3 | 1.679 | 1.679 | 0.000 | (0;000) | ✗ | 05/01/17 |
Na4CdP2 | ICSD | 67262 | R-3m (166) | ✔ | 7 | 58 | 1 | 0.2097 | 0.314 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb6Zn7 | ICSD | 645562 | R-3m (166) | ✔ | 13 | 162 | 3 | 0.0 | 0.009 | 0.450 | (1;111) | ✗ | 02/02/17 |
Ba2CuBrO2 | COD | 2002478 | R-3m (166) | ✔ | 6 | 50 | 2 | 2.3456 | 2.346 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2BrN | ICSD | 262056 | R-3m (166) | ✔ | 4 | 32 | 1 | 0.9748 | 0.975 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2CuClO2 | COD | 2002176 | R-3m (166) | ✔ | 6 | 50 | 2 | 2.3733 | 2.373 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2NCl | ICSD | 262051 | R-3m (166) | ✔ | 4 | 32 | 1 | 0.9986 | 0.999 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2PCl | ICSD | 28134 | R-3m (166) | ✔ | 4 | 32 | 1 | 0.9165 | 0.956 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ga2Te3 | ICSD | 657608 | R-3m (166) | ✔ | 5 | 44 | 2 | 0.0 | 0.032 | 0.483 | (1;111) | ✗ | 27/01/17 |
YTlSe2 | ICSD | 652075 | R-3m (166) | ✔ | 4 | 36 | 2 | 1.1254 | 1.777 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2NF | ICSD | 262049 | R-3m (166) | ✔ | 4 | 32 | 1 | 0.9466 | 0.947 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2HN | COD | 4030485 | R-3m (166) | ✔ | 4 | 26 | 1 | 1.046 | 1.336 | 0.000 | (0;000) | ✗ | 05/01/17 |
NiO | ICSD | 246910 | R-3m (166) | ✔ | 2 | 16 | 3 | 0.0 | 0.000 | 0.631 | (0;000) | ✔ | 06/10/16 |
KLi6TaO6 | ICSD | 73159 | R-3m (166) | ✔ | 14 | 76 | 1 | 4.4879 | 4.670 | 0.000 | (0;000) | ✗ | 27/01/17 |
KYS2 | COD | 2105803 | R-3m (166) | ✔ | 4 | 32 | 2 | 2.2739 | 2.974 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2ZrTiO6 | ICSD | 189098 | R-3m (166) | ✔ | 10 | 72 | 3 | 2.1463 | 2.146 | 0.000 | (0;000) | ✗ | 05/01/17 |