▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Mn2CuO4 | COD | 1530385 | Fd-3m (227) | ✔ | 14 | 130 | 3 | 0.0 | 0.000 | 0.868 | (0;000) | ✗ | 27/01/17 |
MnCuO2 | COD | 9011834 | C2/m (12) | ✔ | 4 | 38 | 3 | 0.0 | 0.040 | 0.274 | (0;000) | ✗ | 27/01/17 |
GaP | ICSD | 103795 | F-43m (216) | ✗ | 2 | 18 | 3 | 1.5678 | 1.791 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiAlO2 | COD | 9009880 | R-3m (166) | ✔ | 4 | 18 | 2 | 6.4953 | 6.634 | 0.000 | (0;000) | ✗ | 05/01/17 |
GaP | ICSD | 190425 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 1.3812 | 1.457 | 0.000 | (0;000) | ✗ | 06/10/16 |
TaCuN2 | COD | 4030363 | R-3m (166) | ✔ | 4 | 34 | 3 | 0.8763 | 1.447 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2CuP | COD | 7221368 | Cmcm (63) | ✔ | 8 | 68 | 1 | 0.6224 | 0.756 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na5CuSO2 | ICSD | 412977 | P4/mmm (123) | ✔ | 9 | 74 | 1 | 1.5015 | 1.594 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaCuO2 | COD | 1529687 | C2/m (12) | ✔ | 4 | 32 | 2 | 0.5401 | 0.941 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaCuO | COD | 1527531 | I4/m (87) | ✔ | 12 | 104 | 3 | 1.2829 | 1.388 | 0.000 | (0;000) | ✗ | 27/01/17 |
GaAsO4 | ICSD | 423937 | C222_1 (20) | ✗ | 12 | 84 | 3 | 2.5122 | 2.512 | 0.000 | (0;000) | ✗ | 06/10/16 |
NaCuTe | COD | 7221371 | P4/nmm (129) | ✔ | 6 | 52 | 1 | 0.4336 | 0.434 | 0.000 | (0;000) | ✗ | 27/01/17 |
KSnAs | ICSD | 40815 | Ccm2_1 (36) | ✗ | 6 | 56 | 0 | 0.4164 | 0.458 | 0.000 | (0;000) | ✔ | 06/10/16 |
KSnAs | ICSD | 610765 | P6_3mc (186) | ✗ | 6 | 56 | 1 | 0.5034 | 0.530 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfBe2 | ICSD | 616288 | P6/mmm (191) | ✔ | 3 | 20 | 1 | 0.0 | 0.009 | 0.660 | (0;000) | ✗ | 05/01/17 |
TiCuNi2 | ICSD | 628580 | Pmmn (59) | ✔ | 8 | 86 | 3 | 0.0 | 0.000 | 0.801 | (0;000) | ✗ | 27/01/17 |
RbCuO2 | COD | 1527506 | Cmcm (63) | ✔ | 8 | 64 | 2 | 0.9467 | 1.340 | 0.000 | (0;000) | ✗ | 27/01/17 |
CuRhO2 | COD | 1008162 | R-3m (166) | ✔ | 4 | 40 | 3 | 0.9783 | 1.390 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScCuO2 | ICSD | 65547 | R-3m (166) | ✔ | 4 | 34 | 3 | 2.0799 | 2.080 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScCuO2 | COD | 4000157 | P6_3/mmc (194) | ✔ | 8 | 68 | 3 | 2.3272 | 2.327 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mg(BeN)2 | ICSD | 413358 | P-3m1 (164) | ✔ | 5 | 28 | 1 | 4.042 | 4.949 | 0.000 | (0;000) | ✗ | 05/01/17 |
YCuO2 | ICSD | 60848 | R-3m (166) | ✔ | 4 | 34 | 3 | 2.648 | 2.678 | 0.000 | (0;000) | ✗ | 27/01/17 |
YCuO2 | COD | 1531596 | P6_3/mmc (194) | ✔ | 8 | 68 | 3 | 2.6666 | 2.667 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaF2 | ICSD | 41651 | P6_3/mmc (194) | ✔ | 6 | 48 | 2 | 5.7976 | 6.002 | 0.000 | (0;000) | ✗ | 05/01/17 |
VCuO3 | COD | 1530636 | R-3 (148) | ✔ | 10 | 84 | 3 | 0.6355 | 0.683 | 0.000 | (0;000) | ✗ | 27/01/17 |
Cu(RhO2)2 | ICSD | 88962 | Fd-3m (227) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.923 | (0;000) | ✗ | 27/01/17 |
KSnAs | ICSD | 65413 | P6_3mc (186) | ✗ | 6 | 56 | 1 | 0.4164 | 0.458 | 0.000 | (0;000) | ✔ | 06/10/16 |
CuSeO4 | ICSD | 109073 | Cmcm (63) | ✔ | 12 | 82 | 3 | 0.0 | 0.000 | 0.640 | (0;000) | ✗ | 27/01/17 |
NaBeH3 | COD | 4343940 | Pm-3m (221) | ✔ | 5 | 16 | 1 | 1.0974 | 4.012 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cu(SbO3)2 | ICSD | 84789 | P4_2/mnm (136) | ✔ | 18 | 114 | 3 | 0.0 | 0.000 | 0.877 | (0;000) | ✗ | 27/01/17 |
KZnAs | ICSD | 43985 | P-6m2 (187) | ✗ | 3 | 26 | 2 | 0.2099 | 0.326 | 0.000 | (0;000) | ✔ | 06/10/16 |
BeNi | ICSD | 616363 | Pm-3m (221) | ✔ | 2 | 14 | 3 | 0.0 | 0.033 | 0.428 | (0;000) | ✗ | 05/01/17 |
CuP2 | ICSD | 628625 | P2_1/c (14) | ✔ | 12 | 84 | 2 | 0.8546 | 0.855 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiAsS2 | ICSD | 419061 | Cc (9) | ✗ | 8 | 40 | 1 | 1.0844 | 1.085 | 0.000 | (0;000) | ✗ | 06/10/16 |
BePd | COD | 9008808 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.053 | 0.538 | (0;000) | ✗ | 05/01/17 |
SrCuP | ICSD | 53323 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.0 | 0.540 | 0.110 | (0;000) | ✗ | 27/01/17 |
BeSe | ICSD | 53934 | Fm-3m (225) | ✔ | 2 | 10 | 1 | 0.0 | 2.642 | 0.027 | (0;000) | ✗ | 05/01/17 |
LiAsSe2 | ICSD | 248116 | Cc (9) | ✗ | 8 | 40 | 1 | 0.6983 | 0.797 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrCuSb | ICSD | 53339 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.386 | 0.132 | (0;000) | ✗ | 27/01/17 |
BN | ICSD | 186248 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 3.5701 | 3.601 | 0.000 | (0;000) | ✗ | 27/01/17 |
KHCO3 | COD | 9010242 | P-1 (2) | ✔ | 12 | 64 | 1 | 5.7378 | 5.871 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li2CuP | COD | 4000338 | P6_3/mmc (194) | ✔ | 8 | 44 | 2 | 0.0 | 0.718 | 0.239 | (0;000) | ✗ | 27/01/17 |
CuSe2 | COD | 9012554 | Pnnm (58) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.942 | (0;000) | ✗ | 27/01/17 |
GaSb | ICSD | 190426 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.0 | 0.008 | 0.010 | (0;000) | ✔ | 06/10/16 |
BN | COD | 1010331 | P6/mmm (191) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.351 | (0;000) | ✗ | 27/01/17 |
YSiCu | ICSD | 30772 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.0 | 0.007 | 0.344 | (0;000) | ✗ | 27/01/17 |
LiAsSe2 | ICSD | 248118 | P-1 (2) | ✔ | 8 | 40 | 1 | 0.0 | 0.096 | 0.008 | (0;000) | ✗ | 06/10/16 |
BN | COD | 2016173 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 4.1848 | 4.579 | 0.000 | (0;000) | ✗ | 27/01/17 |
BiBr3 | ICSD | 100294 | C2/m (12) | ✔ | 8 | 72 | 2 | 2.0254 | 2.057 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaO2 | ICSD | 180398 | Cmmm (65) | ✔ | 3 | 22 | 2 | 0.6441 | 1.164 | 0.000 | (0;000) | ✗ | 05/01/17 |