▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
FeCu2(CN)6 | COD | 1010358 | F-43m (216) | ✗ | 15 | 84 | 3 | 0.0 | 0.000 | 0.630 | ? | ✗ | 21/03/17 |
K2ZnTe2 | ICSD | 420088 | Ibam (72) | ✔ | 10 | 84 | 1 | 1.8566 | 1.935 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaI(OF)2 | COD | 2016692 | Cmcm (63) | ✔ | 12 | 84 | 1 | 4.7043 | 4.786 | 0.000 | (0;000) | ✗ | 22/03/17 |
Sr(CuSb)2 | ICSD | 41923 | P4/nmm (129) | ✔ | 10 | 84 | 3 | 0.0 | 0.004 | 0.483 | (0;001) | ✗ | 02/02/17 |
SnI2 | ICSD | 2831 | C2/m (12) | ✔ | 9 | 84 | 3 | 1.373 | 1.650 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaHg | COD | 2310235 | Cmcm (63) | ✔ | 8 | 84 | 3 | 0.0 | 0.014 | 0.562 | (0;000) | ✗ | 02/02/17 |
Ge4PbO9 | COD | 1530751 | C2 (5) | ✗ | 14 | 84 | 3 | 3.188 | 3.292 | 0.000 | (0;000) | ✗ | 15/02/17 |
MgB9N | COD | 2012796 | R-3m (166) | ✔ | 22 | 84 | 3 | 1.6873 | 1.742 | 0.000 | (0;000) | ✗ | 04/08/17 |
KTeOF3 | ICSD | 201155 | P2_1 (4) | ✗ | 12 | 84 | 1 | 1.8951 | 2.024 | 0.000 | (0;000) | ✗ | 22/03/17 |
KZrCuSe3 | ICSD | 80625 | Cmcm (63) | ✔ | 12 | 84 | 2 | 0.1374 | 0.137 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZnHgC4(SN)4 | COD | 2008857 | I-4 (82) | ✗ | 14 | 84 | 3 | 2.6464 | 2.859 | 0.000 | (0;000) | ✗ | 21/03/17 |
Li2CaTa2O7 | ICSD | 245841 | I4/mmm (139) | ✔ | 12 | 84 | 2 | 2.3496 | 2.802 | 0.000 | (0;000) | ✗ | 21/03/17 |
NaZrCuS3 | ICSD | 73887 | Cmcm (63) | ✔ | 12 | 84 | 2 | 0.5112 | 0.542 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na2ZnS2 | ICSD | 33235 | Ibam (72) | ✔ | 10 | 84 | 1 | 2.4022 | 2.402 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li2SO5 | COD | 9014347 | P2_1 (4) | ✗ | 16 | 84 | 1 | 0.0 | 0.003 | 0.343 | (0;100) | ✔ | 11/04/17 |
AgC4N3 | COD | 7115405 | Ima2 (46) | ✗ | 16 | 84 | 3 | 3.6159 | 3.621 | 0.000 | (0;000) | ✗ | 21/03/17 |
HfTe5 | COD | 1527386 | Cmcm (63) | ✔ | 12 | 84 | 2 | 0.0451 | 0.045 | 0.000 | (1;110) | ✗ | 02/02/17 |
K2LiBO3 | ICSD | 60949 | C2 (5) | ✗ | 14 | 84 | 1 | 3.8165 | 3.823 | 0.000 | (0;000) | ✗ | 15/02/17 |
CoGe | ICSD | 623422 | P2_13 (198) | ✗ | 8 | 84 | 3 | 0.0 | 0.000 | 0.232 | (1;110) | ✔ | 15/02/17 |
ZnHgC4(SeN)4 | ICSD | 188764 | I-4 (82) | ✗ | 14 | 84 | 3 | 2.4413 | 2.735 | 0.000 | (0;000) | ✗ | 21/03/17 |
Sr2GaGeN | ICSD | 420413 | P2_1/m (11) | ✔ | 10 | 84 | 1 | 0.0 | 0.566 | 0.036 | (0;000) | ✗ | 02/02/17 |
KLiSO4 | ICSD | 36038 | P6_3 (173) | ✗ | 14 | 84 | 1 | 5.5615 | 5.633 | 0.000 | (0;000) | ✗ | 15/02/17 |
CsTiI3 | ICSD | 154258 | P6_3/mmc (194) | ✔ | 10 | 84 | 1 | 0.0 | 0.014 | 0.483 | (0;000) | ✗ | 02/02/17 |
BaCaCO3 | ICSD | 27421 | P6_3mc (186) | ✗ | 12 | 84 | 1 | 0.0 | 0.030 | 0.029 | (0;000) | ✔ | 22/03/17 |
KZnB(H2Cl)2 | ICSD | 174294 | P2_1/m (11) | ✔ | 18 | 84 | 1 | 4.9323 | 4.932 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaAu | ICSD | 419559 | Pmnb (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.005 | 0.453 | (1;011) | ✗ | 06/10/16 |
Cu2Cl2O | COD | 9004694 | Fddd (70) | ✔ | 10 | 84 | 3 | 0.0 | 0.029 | 0.430 | (1;111) | ✗ | 27/01/17 |
Ba(CuSb)2 | ICSD | 236308 | P4/nmm (129) | ✔ | 10 | 84 | 3 | 0.0 | 0.010 | 0.517 | (1;000) | ✗ | 02/02/17 |
Zr5Te4 | ICSD | 409337 | I4/m (87) | ✔ | 9 | 84 | 3 | 0.0 | 0.002 | 0.686 | (1;111) | ✗ | 06/10/16 |
MnFeAs | ICSD | 93239 | P-62m (189) | ✗ | 9 | 84 | 3 | 0.0 | 0.000 | 0.434 | ? | ✗ | 06/10/16 |
MnFeAs | ICSD | 93240 | P-62m (189) | ✗ | 9 | 84 | 3 | 0.0 | 0.001 | 0.455 | ? | ✗ | 06/10/16 |
GaAsO4 | ICSD | 423937 | C222_1 (20) | ✗ | 12 | 84 | 3 | 2.5122 | 2.512 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ti2InN | ICSD | 640030 | P6_3/mmc (194) | ✔ | 8 | 84 | 3 | 0.0 | 0.015 | 0.496 | (1;000) | ✗ | 27/01/17 |
InPO4 | COD | 2310636 | Cmcm (63) | ✔ | 12 | 84 | 3 | 2.9447 | 3.247 | 0.000 | (0;000) | ✗ | 27/01/17 |
NiAsS | ICSD | 20309 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.633 | ? | ✗ | 06/10/16 |
NiAsS | ICSD | 53937 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.596 | ? | ✗ | 06/10/16 |
NiAsS | ICSD | 93899 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.615 | ? | ✗ | 06/10/16 |
NiAsSe | ICSD | 93901 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.690 | ? | ✗ | 06/10/16 |
Cs2KMnF6 | ICSD | 91037 | Fm-3m (225) | ✔ | 10 | 84 | 1 | 0.0189 | 0.052 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2CdAs2 | ICSD | 422941 | Cmc2_1 (36) | ✗ | 10 | 84 | 1 | 0.4169 | 0.417 | 0.000 | (0;000) | ✔ | 28/11/16 |
BaAg | ICSD | 260623 | Pmnb (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.353 | (1;011) | ✗ | 06/10/16 |
Ca2CdAs2 | ICSD | 422579 | Ccm2_1 (36) | ✗ | 10 | 84 | 1 | 0.8205 | 0.821 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr2CdAs2 | ICSD | 422940 | Ccm2_1 (36) | ✗ | 10 | 84 | 1 | 0.5433 | 0.543 | 0.000 | (0;000) | ✗ | 06/10/16 |
Hf2PbC | ICSD | 618050 | P6_3/mmc (194) | ✔ | 8 | 84 | 3 | 0.0 | 0.109 | 0.567 | (1;000) | ✗ | 27/01/17 |
Ti2PbC | ICSD | 42926 | P6_3/mmc (194) | ✔ | 8 | 84 | 3 | 0.0 | 0.012 | 0.650 | (1;000) | ✗ | 27/01/17 |
CdSO4 | ICSD | 130014 | P-3m1 (164) | ✔ | 12 | 84 | 3 | 0.0 | 0.017 | 0.574 | (0;001) | ✗ | 27/01/17 |
K3Bi | ICSD | 26885 | Ccmm (63) | ✔ | 8 | 84 | 1 | 0.0 | 0.006 | 0.037 | (0;000) | ✗ | 06/10/16 |
Mg3Hg | COD | 1523297 | P6_3/mmc (194) | ✔ | 8 | 84 | 3 | 0.0 | 0.023 | 0.588 | (1;000) | ✗ | 27/01/17 |
Mg3Cd | COD | 4123952 | P6_3/mmc (194) | ✔ | 8 | 84 | 3 | 0.0 | 0.016 | 0.588 | (1;000) | ✗ | 27/01/17 |
Na3Bi | ICSD | 26881 | Ccmm (63) | ✔ | 8 | 84 | 1 | 0.0 | 0.029 | 0.008 | (1;000) | ✗ | 06/10/16 |