▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
MgSe | ICSD | 658986 | P6_3mc (186) | ✗ | 4 | 32 | 3 | 2.3123 | 2.313 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlF3 | ICSD | 130021 | Pm-3m (221) | ✔ | 4 | 24 | 3 | 7.6687 | 8.500 | 0.000 | (0;000) | ✗ | 05/01/17 |
LiScS2 | ICSD | 642305 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.5243 | 2.409 | 0.000 | (0;000) | ✗ | 27/01/17 |
AgCl | COD | 9011674 | P2_1/m (11) | ✔ | 4 | 36 | 3 | 0.6411 | 2.372 | 0.000 | (0;000) | ✗ | 05/01/17 |
AgCl | COD | 9011680 | Cmcm (63) | ✔ | 4 | 36 | 3 | 0.6339 | 1.812 | 0.000 | (0;000) | ✗ | 05/01/17 |
MnAlFe2 | ICSD | 57806 | Fm-3m (225) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.764 | (1;000) | ✗ | 05/01/17 |
Li2ZnSn | COD | 1522875 | Fm-3m (225) | ✔ | 4 | 32 | 3 | 0.0 | 0.000 | 0.574 | (0;000) | ✗ | 27/01/17 |
CuAgO2 | COD | 1509289 | C2/m (12) | ✔ | 4 | 34 | 3 | 0.0 | 0.165 | 0.014 | (0;000) | ✗ | 05/01/17 |
CaAg | COD | 1509163 | Cmcm (63) | ✔ | 4 | 42 | 1 | 0.0 | 0.000 | 0.626 | (0;000) | ✗ | 05/01/17 |
BrCl | ICSD | 424850 | Cmc2_1 (36) | ✗ | 4 | 28 | 1 | 1.895 | 1.911 | 0.000 | (0;000) | ✗ | 06/10/16 |
AgBr | COD | 9011692 | P2_1/m (11) | ✔ | 4 | 36 | 3 | 0.178 | 1.794 | 0.000 | (0;000) | ✗ | 05/01/17 |
MnAlPt2 | ICSD | 57985 | Fm-3m (225) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.570 | (0;000) | ✗ | 05/01/17 |
NaLi2N | COD | 1526562 | Fm-3m (225) | ✔ | 4 | 20 | 1 | 2.8455 | 2.846 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaLi2Sb | ICSD | 54244 | Fm-3m (225) | ✔ | 4 | 20 | 1 | 0.483 | 1.512 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaLi2N | COD | 1526563 | Cmmm (65) | ✔ | 4 | 20 | 2 | 0.0 | 0.008 | 0.571 | (1;110) | ✗ | 27/01/17 |
KYTe2 | ICSD | 419995 | R-3m (166) | ✔ | 4 | 32 | 3 | 0.682 | 1.760 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li2MgPb | COD | 1522014 | Fm-3m (225) | ✔ | 4 | 30 | 1 | 0.0 | 0.000 | 0.455 | (1;000) | ✗ | 27/01/17 |
NaLi2N | COD | 1526565 | P6/mmm (191) | ✔ | 4 | 20 | 1 | 0.0 | 0.010 | 0.057 | (1;000) | ✗ | 27/01/17 |
AgBiTe2 | COD | 1509245 | R-3m (166) | ✔ | 4 | 38 | 3 | 0.0 | 0.400 | 0.164 | (0;000) | ✗ | 05/01/17 |
CaHgO2 | ICSD | 80717 | R-3m (166) | ✔ | 4 | 34 | 2 | 2.556 | 2.950 | 0.000 | (0;000) | ✗ | 27/01/17 |
TaAlNi2 | ICSD | 608870 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.000 | 0.260 | (1;000) | ✗ | 05/01/17 |
AlVNi2 | ICSD | 58071 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.007 | 0.267 | (1;000) | ✗ | 05/01/17 |
ZrAg | COD | 1509569 | P4/nmm (129) | ✔ | 4 | 30 | 3 | 0.0 | 0.000 | 0.856 | (0;000) | ✗ | 05/01/17 |
BaHgO2 | ICSD | 74076 | R-3m (166) | ✔ | 4 | 34 | 1 | 2.5459 | 2.704 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaPd | ICSD | 616028 | Cmcm (63) | ✔ | 4 | 56 | 2 | 0.0 | 0.065 | 0.082 | (1;011) | ✗ | 05/01/17 |
NaNO2 | ICSD | 9265 | Imm2 (44) | ✗ | 4 | 26 | 1 | 2.5403 | 2.720 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiVS2 | COD | 1528269 | P-3m1 (164) | ✔ | 4 | 28 | 2 | 0.0 | 0.000 | 0.446 | (0;000) | ✗ | 27/01/17 |
KNa2Sb | ICSD | 44332 | Fm-3m (225) | ✔ | 4 | 32 | 1 | 0.5785 | 0.579 | 0.000 | (0;000) | ✗ | 27/01/17 |
K3Sb | ICSD | 44677 | Fm-3m (225) | ✔ | 4 | 32 | 1 | 0.6121 | 0.612 | 0.000 | (0;000) | ✗ | 27/01/17 |
KScO2 | ICSD | 34958 | R-3m (166) | ✔ | 4 | 32 | 2 | 3.7269 | 4.188 | 0.000 | (0;000) | ✗ | 27/01/17 |
AgCNO | ICSD | 27678 | Cmmm (65) | ✔ | 4 | 26 | 1 | 0.0 | 0.106 | 0.264 | (0;110) | ✗ | 27/01/17 |
KTlO2 | ICSD | 33553 | R-3m (166) | ✔ | 4 | 34 | 2 | 0.9793 | 1.140 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrIr | ICSD | 657956 | P2_1/m (11) | ✔ | 4 | 42 | 3 | 0.0 | 0.000 | 0.743 | (1;001) | ✗ | 27/01/17 |
LiAuC2 | ICSD | 411253 | P-6m2 (187) | ✗ | 4 | 22 | 1 | 1.3575 | 1.469 | 0.000 | (0;000) | ✗ | 06/10/16 |
KYO2 | ICSD | 49650 | R-3m (166) | ✔ | 4 | 32 | 2 | 3.4027 | 3.622 | 0.000 | (0;000) | ✗ | 27/01/17 |
NbN | ICSD | 185442 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.0 | 0.008 | 0.291 | (1;100) | ✔ | 06/10/16 |
ScCuS2 | ICSD | 15298 | P3m1 (156) | ✗ | 4 | 34 | 3 | 0.8732 | 1.546 | 0.000 | (0;000) | ✗ | 06/10/16 |
VIr | COD | 2310206 | Cmmm (65) | ✔ | 4 | 60 | 3 | 0.0 | 0.017 | 0.606 | (0;111) | ✗ | 27/01/17 |
CaGa | ICSD | 619272 | Cmcm (63) | ✔ | 4 | 46 | 1 | 0.0 | 0.000 | 0.934 | (0;110) | ✗ | 27/01/17 |
CaFeO2 | COD | 4124115 | P4/mmm (123) | ✔ | 4 | 30 | 2 | 0.0 | 0.009 | 0.726 | (0;000) | ✗ | 27/01/17 |
IrW | COD | 1523681 | Pmma (51) | ✔ | 4 | 62 | 3 | 0.0 | 0.000 | 0.984 | (0;101) | ✗ | 27/01/17 |
Cd2AgAu | COD | 2310024 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.001 | 0.855 | (1;000) | ✗ | 05/01/17 |
SnIr | COD | 1522618 | P6_3/mmc (194) | ✔ | 4 | 62 | 3 | 0.0 | 0.000 | 0.902 | (0;000) | ✗ | 27/01/17 |
Zn2AgAu | COD | 2310025 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.017 | 0.856 | (0;000) | ✗ | 05/01/17 |
Cl2 | COD | 9013120 | Cmce (64) | ✔ | 4 | 28 | 1 | 2.5394 | 2.567 | 0.000 | (0;000) | ✗ | 27/01/17 |
YCoC2 | ICSD | 57007 | C2mm (38) | ✗ | 4 | 28 | 3 | 0.0 | 0.036 | 0.259 | (1;100) | ✔ | 06/10/16 |
TeIr | COD | 9008897 | P6_3/mmc (194) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.772 | (0;000) | ✗ | 27/01/17 |
KP | COD | 9016510 | I4_1/amd (141) | ✔ | 4 | 28 | 1 | 0.0 | 0.015 | 0.048 | (1;111) | ✗ | 27/01/17 |
GeS | ICSD | 155418 | Cmcm (63) | ✔ | 4 | 20 | 3 | 0.0 | 0.012 | 0.256 | (0;000) | ✗ | 06/10/16 |
BiRh | ICSD | 109109 | P6_3/mmc (194) | ✔ | 4 | 44 | 3 | 0.0 | 0.010 | 0.572 | (0;000) | ✗ | 06/10/16 |