▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Li2GePd | ICSD | 53674 | Fm-3m (225) | ✔ | 4 | 28 | 3 | 0.0 | 0.000 | 0.863 | (1;000) | ✗ | 27/01/17 |
RbCuC2 | ICSD | 391118 | P4/mmm (123) | ✔ | 4 | 28 | 1 | 1.9709 | 2.051 | 0.000 | (0;000) | ✗ | 27/01/17 |
BrCl | ICSD | 424850 | Cmc2_1 (36) | ✗ | 4 | 28 | 1 | 1.895 | 1.911 | 0.000 | (0;000) | ✗ | 06/10/16 |
RbAuC2 | ICSD | 411252 | P4/mmm (123) | ✔ | 4 | 28 | 1 | 1.7472 | 1.828 | 0.000 | (0;000) | ✗ | 27/01/17 |
Bi2Te3 | ICSD | 20289 | R3m (160) | ✗ | 5 | 28 | 3 | 0.0 | 0.026 | 0.183 | (1;111) | ✔ | 06/10/16 |
NaAuC2 | ICSD | 411254 | P4/mmm (123) | ✔ | 4 | 28 | 1 | 1.092 | 1.389 | 0.000 | (0;000) | ✗ | 27/01/17 |
CdCuSb | ICSD | 52796 | F-43m (216) | ✗ | 3 | 28 | 3 | 0.0 | 0.000 | 0.318 | (1;000) | ✔ | 15/02/17 |
TlBi | ICSD | 53967 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.000 | 0.632 | (1;111) | ✗ | 05/01/17 |
YCoC2 | ICSD | 617468 | C2mm (38) | ✗ | 4 | 28 | 3 | 0.0 | 0.032 | 0.257 | (0;000) | ✔ | 06/10/16 |
SrB6 | COD | 5910016 | Pm-3m (221) | ✔ | 7 | 28 | 3 | 0.1634 | 0.163 | 0.000 | (0;000) | ✗ | 05/01/17 |
LiMgBi | ICSD | 108112 | F-43m (216) | ✗ | 3 | 28 | 3 | 0.0 | 0.000 | 0.010 | (0;000) | ✔ | 15/02/17 |
KAgC2 | ICSD | 410874 | P4/mmm (123) | ✔ | 4 | 28 | 1 | 2.3634 | 2.681 | 0.000 | (0;000) | ✗ | 27/01/17 |
BH6N | ICSD | 181422 | Cmc2_1 (36) | ✗ | 16 | 28 | 1 | 6.5504 | 6.904 | 0.000 | (0;000) | ✗ | 15/02/17 |
BH6N | ICSD | 237078 | Cmc2_1 (36) | ✗ | 16 | 28 | 1 | 5.397 | 5.563 | 0.000 | (0;000) | ✗ | 15/02/17 |
BaB6 | COD | 1009052 | Pm-3m (221) | ✔ | 7 | 28 | 3 | 0.0 | 0.006 | 0.010 | (1;111) | ✗ | 05/01/17 |
CsAuC2 | ICSD | 411251 | P4/mmm (123) | ✔ | 4 | 28 | 1 | 1.6056 | 1.606 | 0.000 | (0;000) | ✗ | 27/01/17 |
CuAsSe2 | ICSD | 42884 | R3m (160) | ✗ | 4 | 28 | 3 | 0.0 | 0.298 | 0.023 | (0;000) | ✔ | 06/10/16 |
Bi2O3 | ICSD | 168808 | P-4m2 (115) | ✗ | 5 | 28 | 3 | 0.0567 | 0.494 | 0.000 | (0;000) | ✔ | 06/10/16 |
KAuC2 | ICSD | 411255 | P4/mmm (123) | ✔ | 4 | 28 | 1 | 1.8204 | 2.063 | 0.000 | (0;000) | ✗ | 27/01/17 |
BH6N | COD | 4116439 | Pmn2_1 (31) | ✗ | 16 | 28 | 1 | 5.5448 | 5.545 | 0.000 | (0;000) | ✗ | 15/02/17 |
Mg(BeP)2 | ICSD | 616328 | P-3m1 (164) | ✔ | 5 | 28 | 1 | 0.5227 | 2.649 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ca(BeP)2 | ICSD | 616191 | P-3m1 (164) | ✔ | 5 | 28 | 1 | 0.8415 | 1.509 | 0.000 | (0;000) | ✗ | 05/01/17 |
ScCo | COD | 1523971 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.024 | 0.314 | (0;000) | ✗ | 27/01/17 |
GaBi | ICSD | 167768 | F-43m (216) | ✗ | 2 | 28 | 3 | 0.0 | 0.000 | 0.253 | (1;000) | ✔ | 06/10/16 |
Br | COD | 9013118 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.7043 | 1.768 | 0.000 | (0;000) | ✗ | 27/01/17 |
Be5Fe | ICSD | 616267 | F-43m (216) | ✗ | 6 | 28 | 1 | 0.0 | 0.000 | 0.556 | ? | ✗ | 15/02/17 |
Zr2O | ICSD | 77714 | Pn-3m (224) | ✔ | 6 | 28 | 3 | 0.0 | 0.000 | 0.564 | (0;111) | ✗ | 27/01/17 |
LiGaO2 | ICSD | 28388 | R-3m (166) | ✔ | 4 | 28 | 2 | 4.0872 | 4.268 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaSi | ICSD | 191760 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.020 | 0.547 | (1;110) | ✗ | 06/10/16 |
Pb | ICSD | 648350 | P6_3/mmc (194) | ✔ | 2 | 28 | 3 | 0.0 | 0.003 | 0.725 | (1;000) | ✗ | 27/01/17 |
BaGe | ICSD | 52688 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.011 | 0.146 | (0;110) | ✗ | 06/10/16 |
Br | COD | 1512496 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.1847 | 1.185 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrB6 | ICSD | 50313 | Pm-3m (221) | ✔ | 7 | 28 | 3 | 0.0 | 0.002 | 0.010 | (1;111) | ✗ | 06/10/16 |
YCoC2 | ICSD | 57007 | C2mm (38) | ✗ | 4 | 28 | 3 | 0.0 | 0.036 | 0.259 | (1;100) | ✔ | 06/10/16 |
LiVS2 | COD | 1528269 | P-3m1 (164) | ✔ | 4 | 28 | 2 | 0.0 | 0.000 | 0.446 | (0;000) | ✗ | 27/01/17 |
AgSbTe2 | COD | 4111783 | P4/mmm (123) | ✔ | 4 | 28 | 3 | 0.0 | 0.038 | 0.221 | (0;110) | ✗ | 05/01/17 |
LiAg | ICSD | 247145 | I4_1/amd (141) | ✔ | 4 | 28 | 3 | 0.0 | 0.025 | 0.646 | (1;111) | ✗ | 05/01/17 |
FeS | ICSD | 68847 | Cmc2_1 (36) | ✗ | 4 | 28 | 3 | 0.0 | 0.028 | 0.242 | (0;000) | ✔ | 06/10/16 |
AgSbTe2 | COD | 4111784 | R-3m (166) | ✔ | 4 | 28 | 3 | 0.0 | 0.671 | 0.213 | (0;000) | ✗ | 05/01/17 |
PbF2 | COD | 9009027 | Fm-3m (225) | ✔ | 3 | 28 | 3 | 4.0292 | 4.173 | 0.000 | (0;000) | ✗ | 27/01/17 |
F2 | ICSD | 16262 | C2/c (15) | ✔ | 4 | 28 | 1 | 1.3602 | 1.360 | 0.000 | (0;000) | ✗ | 27/01/17 |
LaAu | ICSD | 612099 | Ccmm (63) | ✔ | 4 | 28 | 3 | 0.0 | 0.013 | 0.464 | (1;000) | ✗ | 06/10/16 |
BaSi | COD | 1526652 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.012 | 0.130 | (0;110) | ✗ | 05/01/17 |
TiOs | COD | 1523502 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.011 | 0.242 | (0;111) | ✗ | 27/01/17 |
YCoC2 | ICSD | 617465 | C2mm (38) | ✗ | 4 | 28 | 3 | 0.0 | 0.036 | 0.259 | (1;100) | ✔ | 06/10/16 |
Sb2TeSe2 | ICSD | 60963 | R3m (160) | ✗ | 5 | 28 | 2 | 0.2074 | 0.207 | 0.000 | (1;000) | ✔ | 06/10/16 |
Te3As2 | ICSD | 41040 | R3m (160) | ✗ | 5 | 28 | 0 | 0.0 | 0.025 | 0.069 | (1;000) | ✔ | 04/10/16 |
ZrSiO | ICSD | 25731 | P4/nmm (129) | ✔ | 6 | 28 | 2 | 0.0 | 0.041 | 0.027 | (0;001) | ✗ | 27/01/17 |
LiO2 | COD | 1514090 | Pnnm (58) | ✔ | 6 | 30 | 1 | 0.0 | 0.000 | 0.990 | (0;110) | ✗ | 27/01/17 |
LiO2 | COD | 9014136 | C2/m (12) | ✔ | 6 | 30 | 1 | 0.0 | 0.004 | 0.735 | (1;110) | ✗ | 27/01/17 |