▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ba3BAsO3 | ICSD | 402682 | P6_3/mmc (194) | ✔ | 16 | 112 | 1 | 1.3926 | 1.694 | 0.000 | (0;000) | ✗ | 30/01/17 |
Mg(ScS2)2 | ICSD | 37423 | Fd-3m (227) | ✔ | 14 | 112 | 3 | 1.5359 | 1.536 | 0.000 | (0;000) | ✗ | 02/02/17 |
CuAgS | ICSD | 66582 | Pmc2_1 (26) | ✗ | 12 | 112 | 3 | 0.7416 | 0.819 | 0.000 | (0;000) | ✗ | 06/10/16 |
Mg(ScSe2)2 | ICSD | 642814 | Fd-3m (227) | ✔ | 14 | 112 | 3 | 0.9141 | 0.914 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na2CrO4 | COD | 1010023 | Cmcm (63) | ✔ | 14 | 112 | 1 | 3.3328 | 3.360 | 0.000 | (0;000) | ✗ | 27/01/17 |
CrSiNi | ICSD | 165255 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.005 | 0.316 | (0;000) | ✗ | 27/01/17 |
Ni(SbO3)2 | ICSD | 80802 | P4_2/mnm (136) | ✔ | 18 | 112 | 3 | 0.0 | 0.011 | 0.339 | (0;000) | ✗ | 27/01/17 |
TiFe2 | COD | 1523306 | P6_3/mmc (194) | ✔ | 12 | 112 | 3 | 0.0 | 0.001 | 0.479 | (1;000) | ✗ | 27/01/17 |
RuO2 | ICSD | 66939 | Pa3 (205) | ✔ | 12 | 112 | 3 | 0.0 | 0.073 | 0.395 | (0;000) | ✗ | 27/01/17 |
Ag2S | COD | 4329109 | P2_1/c (14) | ✔ | 12 | 112 | 3 | 0.0 | 0.020 | 0.016 | (0;000) | ✗ | 05/01/17 |
Sb2O3 | COD | 9012853 | Fd-3m (227) | ✔ | 20 | 112 | 1 | 0.0 | 3.145 | 1.000 | (0;000) | ✗ | 02/02/17 |
SnPbF4 | ICSD | 152955 | P4/nmm (129) | ✔ | 12 | 112 | 1 | 3.3685 | 3.500 | 0.000 | (0;000) | ✗ | 02/02/17 |
Bi2O3 | ICSD | 168812 | P-42_1c (114) | ✗ | 20 | 112 | 3 | 1.4533 | 1.453 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sb2O3 | COD | 9009748 | Pccn (56) | ✔ | 20 | 112 | 3 | 0.0 | 2.096 | 1.000 | (0;000) | ✗ | 02/02/17 |
Bi2O3 | ICSD | 169685 | P31c (159) | ✗ | 20 | 112 | 3 | 1.2724 | 1.273 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sb2O3 | COD | 9000012 | Pccn (56) | ✔ | 20 | 112 | 1 | 0.0 | 1.400 | 1.000 | (0;000) | ✗ | 02/02/17 |
SrPdF4 | ICSD | 108990 | I4/mcm (140) | ✔ | 12 | 112 | 1 | 1.4029 | 1.403 | 0.000 | (0;000) | ✗ | 27/01/17 |
Bi2O3 | ICSD | 422451 | P6_3mc (186) | ✗ | 20 | 112 | 3 | 1.424 | 1.583 | 0.000 | (0;000) | ✗ | 06/10/16 |
KLi3PbO4 | ICSD | 37084 | P-1 (2) | ✔ | 18 | 112 | 2 | 1.829 | 1.830 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2NaAsO4 | ICSD | 36533 | P2_1/m (11) | ✔ | 16 | 112 | 1 | 4.104 | 4.122 | 0.000 | (0;000) | ✗ | 30/01/17 |
AgSbS2 | COD | 9002733 | C2/c (15) | ✔ | 16 | 112 | 3 | 1.2255 | 1.398 | 0.000 | (0;000) | ✗ | 30/01/17 |
NaSbCl6 | ICSD | 36517 | P4_2/m (84) | ✔ | 16 | 112 | 1 | 2.3564 | 2.356 | 0.000 | (0;000) | ✗ | 02/02/17 |
Bi2O3 | ICSD | 15072 | P2_1/c (14) | ✔ | 20 | 112 | 3 | 2.2283 | 2.259 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2O3 | ICSD | 168811 | Fd-3m (227) | ✔ | 20 | 112 | 1 | 2.1934 | 2.260 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2O3 | ICSD | 168815 | Pnab (60) | ✔ | 20 | 112 | 3 | 1.6331 | 1.633 | 0.000 | (0;000) | ✗ | 06/10/16 |
TaNiP | ICSD | 646155 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.028 | 0.235 | (0;000) | ✗ | 27/01/17 |
Bi2O3 | ICSD | 172529 | Pbnb (56) | ✔ | 20 | 112 | 3 | 2.2888 | 2.289 | 0.000 | (0;000) | ✗ | 06/10/16 |
KClO2 | COD | 9014207 | P2_1/m (11) | ✔ | 16 | 112 | 2 | 0.0 | 0.004 | 0.426 | (0;010) | ✗ | 27/01/17 |
Bi2O3 | ICSD | 261777 | Pccn (56) | ✔ | 20 | 112 | 3 | 2.3002 | 2.300 | 0.000 | (0;000) | ✗ | 06/10/16 |
K3NaCr2O8 | COD | 2101077 | P-3m1 (164) | ✔ | 14 | 112 | 1 | 3.2103 | 3.214 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr3(AlAs2)2 | ICSD | 423787 | C2/c (15) | ✔ | 18 | 112 | 2 | 1.1469 | 1.148 | 0.000 | (0;000) | ✗ | 30/01/17 |
ICl | ICSD | 26032 | P2_1/c (14) | ✔ | 16 | 112 | 1 | 0.0 | 0.196 | 0.034 | (0;000) | ✗ | 02/02/17 |
Ca3(AlAs2)2 | ICSD | 60161 | C2/c (15) | ✔ | 18 | 112 | 2 | 1.0249 | 1.025 | 0.000 | (0;000) | ✗ | 30/01/17 |
Bi2S3 | ICSD | 153946 | Pmnb (62) | ✔ | 20 | 112 | 2 | 0.9478 | 0.980 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2S3 | ICSD | 201066 | Pmcn (62) | ✔ | 20 | 112 | 2 | 0.9742 | 1.010 | 0.000 | (0;000) | ✗ | 06/10/16 |
Fe(PdSe)2 | ICSD | 416515 | Ibam (72) | ✔ | 10 | 112 | 3 | 0.0 | 0.009 | 0.269 | (1;111) | ✗ | 27/01/17 |
Bi2Se3 | ICSD | 171571 | Pmnb (62) | ✔ | 20 | 112 | 2 | 0.5886 | 0.597 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2Se3 | ICSD | 60205 | Pmcn (62) | ✔ | 20 | 112 | 2 | 0.5886 | 0.597 | 0.000 | (0;000) | ✗ | 06/10/16 |
Rb3Na(MoO4)2 | ICSD | 191958 | P-3m1 (164) | ✔ | 14 | 112 | 1 | 4.7708 | 4.771 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrBi2 | ICSD | 42880 | Pmnn (58) | ✔ | 24 | 112 | 3 | 0.0 | 0.026 | 0.279 | (0;000) | ✗ | 06/10/16 |
MnTlF4 | ICSD | 168525 | C2/c (15) | ✔ | 12 | 112 | 3 | 0.0 | 0.015 | 0.126 | (0;000) | ✗ | 27/01/17 |
Ti2C | ICSD | 77473 | Fd-3m (227) | ✔ | 12 | 112 | 3 | 0.0 | 0.012 | 0.367 | (0;000) | ✗ | 27/01/17 |
NaAl(SiO3)2 | COD | 9010377 | C2/c (15) | ✔ | 20 | 112 | 3 | 5.953 | 5.965 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ca3(AlP2)2 | ICSD | 423780 | C2/c (15) | ✔ | 18 | 112 | 2 | 1.257 | 1.257 | 0.000 | (0;000) | ✗ | 30/01/17 |
Cs2PtCl4 | COD | 9009288 | Cmcm (63) | ✔ | 14 | 112 | 1 | 1.8445 | 1.845 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca3(AlN2)2 | COD | 4321679 | C2/c (15) | ✔ | 18 | 112 | 2 | 2.5001 | 2.500 | 0.000 | (0;000) | ✗ | 30/01/17 |
VNiP | ICSD | 646176 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.010 | 0.167 | (1;000) | ✗ | 27/01/17 |
NaAs | ICSD | 182159 | P2_1/c (14) | ✔ | 16 | 112 | 1 | 0.8758 | 0.946 | 0.000 | (0;000) | ✗ | 30/01/17 |
I | COD | 5900010 | P2_1/c (14) | ✔ | 16 | 112 | 1 | 0.0 | 0.007 | 0.889 | (1;000) | ✗ | 02/02/17 |
Mg3(HO2)2 | COD | 1531164 | P-3m1 (164) | ✔ | 18 | 112 | 1 | 3.8412 | 3.841 | 0.000 | (0;000) | ✗ | 27/01/17 |