▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BeS | ICSD | 183373 | F-43m (216) | ✗ | 2 | 10 | 1 | 3.0264 | 5.598 | 0.000 | (0;000) | ✗ | 06/10/16 |
AuCl2 | ICSD | 201436 | P-1 (2) | ✔ | 12 | 100 | 1 | 0.7861 | 1.208 | 0.000 | (0;000) | ✗ | 06/10/16 |
BBr3 | ICSD | 173374 | P2_1/m (11) | ✔ | 8 | 48 | 1 | 3.5823 | 3.889 | 0.000 | (0;000) | ✗ | 06/10/16 |
BCl3 | ICSD | 24526 | P2_1/m (11) | ✔ | 8 | 48 | 1 | 3.2389 | 3.347 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeSe | ICSD | 183374 | F-43m (216) | ✗ | 2 | 10 | 1 | 2.4499 | 4.314 | 0.000 | (0;000) | ✗ | 06/10/16 |
BI3 | ICSD | 173375 | P2_1/m (11) | ✔ | 8 | 48 | 1 | 2.4262 | 2.516 | 0.000 | (0;000) | ✗ | 06/10/16 |
KSnSe2 | ICSD | 153907 | I4cm (108) | ✗ | 8 | 70 | 1 | 0.0 | 0.000 | 0.296 | (1;111) | ✔ | 07/10/16 |
K3NbO8 | ICSD | 30405 | I-42m (121) | ✗ | 12 | 88 | 1 | 1.5824 | 1.656 | 0.000 | (0;000) | ✗ | 07/10/16 |
K3TaO8 | ICSD | 30406 | I-42m (121) | ✗ | 12 | 88 | 1 | 2.2024 | 2.276 | 0.000 | (0;000) | ✗ | 07/10/16 |
BeTe | ICSD | 183375 | F-43m (216) | ✗ | 2 | 10 | 1 | 1.572 | 3.253 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaLiAs | ICSD | 56445 | P-6m2 (187) | ✗ | 3 | 18 | 1 | 0.4512 | 0.451 | 0.000 | (0;000) | ✔ | 06/10/16 |
Na6PbO5 | ICSD | 15102 | I4mm (107) | ✗ | 12 | 98 | 1 | 1.4651 | 1.529 | 0.000 | (0;000) | ✗ | 07/10/16 |
Rb3NbO8 | ICSD | 407327 | I-42m (121) | ✗ | 12 | 88 | 1 | 3.0135 | 3.184 | 0.000 | (0;000) | ✗ | 07/10/16 |
Rb3TaO8 | ICSD | 150280 | I-42m (121) | ✗ | 12 | 88 | 1 | 2.9156 | 3.105 | 0.000 | (0;000) | ✗ | 07/10/16 |
Ag2S | ICSD | 98453 | P2_1 (4) | ✗ | 6 | 56 | 1 | 0.0 | 0.113 | 0.106 | (1;000) | ✔ | 04/10/16 |
MoBr3 | ICSD | 9422 | Cm2m (38) | ✗ | 8 | 70 | 1 | 0.0 | 0.011 | 0.407 | (0;110) | ✔ | 04/10/16 |
LiIO3 | ICSD | 35475 | P6_3 (173) | ✗ | 10 | 56 | 1 | 3.8193 | 3.892 | 0.000 | (0;000) | ✗ | 29/11/16 |
SrSb2 | ICSD | 52307 | P2_1/m (11) | ✔ | 6 | 40 | 1 | 0.0 | 0.140 | 0.143 | (0;010) | ✔ | 27/01/17 |
Be3N2 | ICSD | 185490 | R3m (160) | ✗ | 5 | 22 | 1 | 2.7756 | 3.816 | 0.000 | (0;000) | ✗ | 06/10/16 |
Be5Pt | ICSD | 616395 | F-43m (216) | ✗ | 6 | 30 | 1 | 0.0 | 0.584 | 0.071 | (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 |
Mg(BeN)2 | ICSD | 413358 | P-3m1 (164) | ✔ | 5 | 28 | 1 | 4.042 | 4.949 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaGe | ICSD | 52688 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.011 | 0.146 | (0;110) | ✗ | 06/10/16 |
BaIn | ICSD | 414228 | Cmcm (63) | ✔ | 8 | 92 | 1 | 0.0 | 0.011 | 0.250 | (1;000) | ✗ | 02/02/17 |
KSnAs | ICSD | 65413 | P6_3mc (186) | ✗ | 6 | 56 | 1 | 0.4164 | 0.458 | 0.000 | (0;000) | ✔ | 06/10/16 |
NaBeH3 | COD | 4343940 | Pm-3m (221) | ✔ | 5 | 16 | 1 | 1.0974 | 4.012 | 0.000 | (0;000) | ✗ | 05/01/17 |
Be | ICSD | 52708 | Im-3m (229) | ✔ | 1 | 4 | 1 | 0.0 | 0.001 | 0.284 | (1;000) | ✗ | 05/01/17 |
Be | COD | 9012017 | P6_3/mmc (194) | ✔ | 2 | 8 | 1 | 0.0 | 0.001 | 0.153 | (1;000) | ✗ | 05/01/17 |
LiAsS2 | ICSD | 419061 | Cc (9) | ✗ | 8 | 40 | 1 | 1.0844 | 1.085 | 0.000 | (0;000) | ✗ | 06/10/16 |
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 |
LiAsSe2 | ICSD | 248118 | P-1 (2) | ✔ | 8 | 40 | 1 | 0.0 | 0.096 | 0.008 | (0;000) | ✗ | 06/10/16 |
BaPb | ICSD | 58664 | Cmcm (63) | ✔ | 4 | 48 | 1 | 0.0 | 0.085 | 0.123 | (0;110) | ✗ | 06/10/16 |
BaSi | ICSD | 191760 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.020 | 0.547 | (1;110) | ✗ | 06/10/16 |
CaF2 | COD | 9007069 | Fm-3m (225) | ✔ | 3 | 24 | 1 | 7.9254 | 8.174 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaN2 | ICSD | 423721 | I4/mmm (139) | ✔ | 3 | 20 | 1 | 0.0 | 0.006 | 0.578 | (0;000) | ✗ | 27/01/17 |
CaO2 | ICSD | 20275 | I4/mmm (139) | ✔ | 3 | 22 | 1 | 1.5999 | 1.600 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca | COD | 9012917 | Pm-3m (221) | ✔ | 1 | 10 | 1 | 0.0 | 0.000 | 0.233 | (0;000) | ✗ | 27/01/17 |
CaO | COD | 9006708 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 3.649 | 4.030 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaSn | ICSD | 58678 | Cmcm (63) | ✔ | 4 | 48 | 1 | 0.0 | 0.023 | 0.135 | (0;110) | ✗ | 05/01/17 |
NaSrAs | ICSD | 402448 | P-62m (189) | ✗ | 9 | 72 | 1 | 0.8323 | 0.832 | 0.000 | (0;000) | ✗ | 06/10/16 |
Be2C | COD | 9009053 | Fm-3m (225) | ✔ | 3 | 12 | 1 | 1.1755 | 4.135 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2Bi | ICSD | 2141 | I4/mmm (139) | ✔ | 6 | 70 | 1 | 0.0 | 0.014 | 0.226 | (0;111) | ✗ | 02/02/17 |
Ca2Bi | ICSD | 42136 | I4/mmm (139) | ✔ | 6 | 50 | 1 | 0.0 | 0.059 | 0.073 | (0;000) | ✗ | 06/10/16 |
Ba2CdAs2 | ICSD | 422941 | Cmc2_1 (36) | ✗ | 10 | 84 | 1 | 0.4169 | 0.417 | 0.000 | (0;000) | ✔ | 28/11/16 |
LiCl | COD | 1011314 | Fm-3m (225) | ✔ | 2 | 10 | 1 | 6.2774 | 6.277 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 4313211 | Fm-3m (225) | ✔ | 1 | 4 | 1 | 0.0 | 0.005 | 0.580 | (0;000) | ✗ | 27/01/17 |
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 |