▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
MgC2 | ICSD | 88057 | P4_2/mnm (136) | ✔ | 6 | 36 | 2 | 2.874 | 3.338 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrSi2 | COD | 1527358 | I4_1/amd (141) | ✔ | 6 | 36 | 3 | 0.0 | 0.014 | 0.249 | (1;111) | ✗ | 27/01/17 |
K2PtC2 | ICSD | 421491 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.7799 | 0.813 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiSe | COD | 9008919 | P6_3/mmc (194) | ✔ | 4 | 36 | 3 | 0.0 | 0.000 | 0.450 | (0;000) | ✗ | 27/01/17 |
BiF3 | COD | 7202532 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 3.1637 | 3.298 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaLiP | ICSD | 416890 | P6_3/mmc (194) | ✔ | 6 | 36 | 1 | 0.9216 | 0.963 | 0.000 | (0;000) | ✗ | 05/01/17 |
CuBr | ICSD | 30091 | P6_3/mmc (194) | ✔ | 4 | 36 | 3 | 0.4343 | 0.434 | 0.000 | (0;000) | ✔ | 27/01/17 |
BaFeO3 | ICSD | 28917 | Pm-3m (221) | ✔ | 5 | 36 | 3 | 0.0 | 0.000 | 0.819 | (1;000) | ✗ | 06/10/16 |
Li2GaRh | COD | 1527266 | F-43m (216) | ✗ | 4 | 36 | 3 | 0.0 | 0.035 | 0.703 | ? | ✗ | 15/02/17 |
ZrPbO3 | ICSD | 39607 | C2mm (38) | ✗ | 5 | 36 | 3 | 2.0123 | 2.012 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaLiSb | COD | 2200086 | P6_3/mmc (194) | ✔ | 6 | 36 | 1 | 0.4311 | 0.643 | 0.000 | (0;000) | ✗ | 05/01/17 |
YTlSe2 | ICSD | 652075 | R-3m (166) | ✔ | 4 | 36 | 2 | 1.1254 | 1.777 | 0.000 | (0;000) | ✗ | 27/01/17 |
Se | COD | 9013138 | R-3 (148) | ✔ | 6 | 36 | 1 | 1.2105 | 1.351 | 0.000 | (0;000) | ✗ | 27/01/17 |
TaN | COD | 1523630 | P6_3/mmc (194) | ✔ | 4 | 36 | 3 | 0.0 | 0.001 | 0.538 | (0;000) | ✗ | 27/01/17 |
ScTlSe2 | ICSD | 418475 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.4619 | 1.083 | 0.000 | (0;000) | ✗ | 27/01/17 |
Cs2PtC2 | COD | 1526418 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.8218 | 0.869 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScCl | COD | 4343683 | R-3m (166) | ✔ | 4 | 36 | 2 | 0.0 | 0.004 | 0.709 | (0;000) | ✗ | 27/01/17 |
KMnTe2 | ICSD | 87983 | I-4m2 (119) | ✗ | 4 | 36 | 2 | 0.0 | 0.002 | 0.598 | (1;110) | ✔ | 07/10/16 |
Be(H3C)2 | COD | 5900008 | Ibam (72) | ✔ | 18 | 36 | 1 | 4.8496 | 4.850 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiAl2 | COD | 1528043 | Cmmm (65) | ✔ | 6 | 36 | 3 | 0.0 | 0.010 | 0.449 | (1;110) | ✗ | 05/01/17 |
ScTlTe2 | ICSD | 418476 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.0 | 0.243 | 0.108 | (0;000) | ✗ | 27/01/17 |
VSb | ICSD | 23910 | P6_3/mmc (194) | ✔ | 4 | 36 | 3 | 0.0 | 0.001 | 0.446 | (1;000) | ✗ | 27/01/17 |
ScAlAg2 | COD | 1509642 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.005 | 0.281 | (1;000) | ✗ | 05/01/17 |
YCl | ICSD | 30708 | R-3m (166) | ✔ | 4 | 36 | 2 | 0.0 | 0.026 | 0.395 | (0;000) | ✗ | 27/01/17 |
Li2GaIr | ICSD | 107085 | F-43m (216) | ✗ | 4 | 36 | 3 | 0.0 | 0.051 | 0.669 | ? | ✗ | 15/02/17 |
LiH3IN | ICSD | 55064 | P2_1 (4) | ✗ | 12 | 36 | 1 | 3.8239 | 3.825 | 0.000 | (0;000) | ✗ | 15/02/17 |
InCuO2 | COD | 1521924 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.441 | 0.804 | 0.000 | (0;000) | ✗ | 27/01/17 |
YTlS2 | ICSD | 651267 | R-3m (166) | ✔ | 4 | 36 | 2 | 1.4802 | 2.223 | 0.000 | (0;000) | ✗ | 27/01/17 |
CuNi2Sb | ICSD | 53320 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.004 | 0.916 | (1;000) | ✗ | 27/01/17 |
NaBeSb | COD | 7221254 | P6_3/mmc (194) | ✔ | 6 | 36 | 1 | 0.6881 | 1.361 | 0.000 | (0;000) | ✗ | 05/01/17 |
GaCuO2 | ICSD | 60846 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.9088 | 1.630 | 0.000 | (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 |
Hf2Hg | ICSD | 638564 | I4/mmm (139) | ✔ | 3 | 36 | 3 | 0.0 | 0.039 | 0.526 | (0;111) | ✗ | 27/01/17 |
Ba(FeAs)2 | COD | 4123005 | I4/mmm (139) | ✔ | 5 | 36 | 2 | 0.0 | 0.015 | 0.486 | (1;111) | ✗ | 05/01/17 |
NaBeAs | COD | 7221253 | P6_3/mmc (194) | ✔ | 6 | 36 | 1 | 1.1981 | 1.310 | 0.000 | (0;000) | ✗ | 05/01/17 |
NbN | ICSD | 150967 | P6_3/mmc (194) | ✔ | 4 | 36 | 3 | 0.0 | 0.004 | 0.318 | (0;000) | ✗ | 27/01/17 |
GaP | ICSD | 190425 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 1.3812 | 1.457 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaC2 | ICSD | 54185 | C2/m (12) | ✔ | 6 | 36 | 1 | 1.2582 | 1.961 | 0.000 | (0;000) | ✗ | 27/01/17 |
GaN | ICSD | 159250 | P6_3mc (186) | ✗ | 4 | 36 | 2 | 0.0 | 0.015 | 0.236 | (1;000) | ✔ | 06/10/16 |
ZnCdSe2 | ICSD | 188387 | P-4m2 (115) | ✗ | 4 | 36 | 3 | 0.5052 | 0.505 | 0.000 | (0;000) | ✗ | 07/10/16 |
CaGe2 | ICSD | 619304 | R-3m (166) | ✔ | 6 | 36 | 1 | 0.0 | 0.027 | 0.180 | (1;000) | ✗ | 27/01/17 |
KLiSe | ICSD | 67277 | P4/nmm (129) | ✔ | 6 | 36 | 1 | 2.4508 | 2.488 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ga2BiAs | ICSD | 182809 | P-4m2 (115) | ✗ | 4 | 36 | 3 | 0.0 | 0.017 | 0.170 | (0;111) | ✔ | 06/10/16 |
Zr(CuP)2 | ICSD | 628683 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.0 | 0.035 | 0.238 | (1;000) | ✗ | 27/01/17 |
FeSb2 | ICSD | 15003 | P2nn (34) | ✗ | 6 | 36 | 3 | 0.0 | 0.112 | 0.057 | (0;000) | ✔ | 06/10/16 |
ZrP | ICSD | 77860 | P6_3/mmc (194) | ✔ | 8 | 36 | 3 | 0.0 | 0.011 | 0.588 | (0;000) | ✗ | 27/01/17 |
Zr2CS | COD | 9008972 | P6_3/mmc (194) | ✔ | 8 | 36 | 3 | 0.0 | 0.015 | 0.336 | (0;000) | ✗ | 27/01/17 |
Y3Al | ICSD | 58212 | Pm-3m (221) | ✔ | 4 | 36 | 3 | 0.0 | 0.000 | 0.809 | (1;111) | ✗ | 05/01/17 |
Hf2Zn | ICSD | 639016 | I4/mmm (139) | ✔ | 3 | 36 | 3 | 0.0 | 0.056 | 0.428 | (0;111) | ✗ | 27/01/17 |
YAlSi | COD | 1533018 | Cmcm (63) | ✔ | 6 | 36 | 3 | 0.0 | 0.015 | 0.313 | (0;110) | ✗ | 05/01/17 |