▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
WS2 | ICSD | 202367 | R3m (160) | ✗ | 3 | 26 | 2 | 0.8802 | 1.635 | 0.000 | (0;000) | ✗ | 06/10/16 |
TiS2 | ICSD | 79803 | C2/m (12) | ✔ | 3 | 24 | 2 | 0.0 | 0.377 | 0.035 | (0;000) | ✔ | 06/10/16 |
ZnCl2 | ICSD | 15916 | I-42d (122) | ✗ | 6 | 52 | 3 | 3.8632 | 3.863 | 0.000 | (0;000) | ✗ | 06/10/16 |
BSb | ICSD | 184571 | F-43m (216) | ✗ | 2 | 8 | 3 | 0.6393 | 2.485 | 0.000 | (0;000) | ✗ | 06/10/16 |
SnS2 | ICSD | 43003 | P6_3mc (186) | ✗ | 6 | 52 | 2 | 1.2053 | 1.498 | 0.000 | (0;000) | ✗ | 06/10/16 |
SiS2 | ICSD | 16952 | I-42d (122) | ✗ | 6 | 32 | 3 | 2.9532 | 3.090 | 0.000 | (0;000) | ✗ | 06/10/16 |
PdCl2 | ICSD | 421221 | P2_1/c (14) | ✔ | 6 | 64 | 2 | 0.6974 | 1.132 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZnS | ICSD | 37373 | R3m (160) | ✗ | 6 | 54 | 0 | 2.1341 | 2.134 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZnS | ICSD | 184810 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 2.4085 | 2.409 | 0.000 | (0;000) | ✗ | 06/10/16 |
PdCl2 | ICSD | 421220 | P2/m (10) | ✔ | 6 | 64 | 1 | 0.7541 | 1.005 | 0.000 | (0;000) | ✗ | 27/01/17 |
BP | ICSD | 615155 | P6_3mc (186) | ✗ | 4 | 16 | 1 | 1.5643 | 1.691 | 0.000 | (0;000) | ✗ | 06/10/16 |
AgP2 | ICSD | 35283 | P2_1/c (14) | ✔ | 12 | 84 | 2 | 0.6204 | 0.634 | 0.000 | (0;000) | ✗ | 06/10/16 |
MnN | ICSD | 236787 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0222 | 0.393 | 0.000 | (0;000) | ✔ | 04/10/16 |
ZnS | ICSD | 108733 | F-43m (216) | ✗ | 2 | 18 | 3 | 2.0623 | 2.062 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZnS | ICSD | 107611 | R3m (160) | ✗ | 2 | 18 | 3 | 2.1125 | 2.113 | 0.000 | (0;000) | ✗ | 06/10/16 |
MgCl2 | ICSD | 51246 | C2cm (40) | ✗ | 6 | 48 | 2 | 0.0 | 0.022 | 0.250 | (1;000) | ✔ | 06/10/16 |
YS | ICSD | 69042 | Fmm2 (42) | ✗ | 4 | 34 | 2 | 0.0 | 0.003 | 0.567 | (0;111) | ✔ | 06/10/16 |
Ni2B | ICSD | 30448 | I4/mcm (140) | ✔ | 6 | 46 | 3 | 0.0 | 0.001 | 0.838 | (0;111) | ✗ | 06/10/16 |
MgCl2 | ICSD | 51245 | P-4m2 (115) | ✗ | 3 | 24 | 2 | 4.679 | 5.054 | 0.000 | (0;000) | ✗ | 06/10/16 |
BP | ICSD | 181291 | F-43m (216) | ✗ | 2 | 8 | 3 | 1.2188 | 3.369 | 0.000 | (0;000) | ✗ | 06/10/16 |
SnS | ICSD | 79374 | C2me (39) | ✗ | 4 | 40 | 2 | 1.0723 | 1.072 | 0.000 | (0;000) | ✗ | 06/10/16 |
SnS | ICSD | 67442 | Cm2e (39) | ✗ | 4 | 40 | 2 | 1.0017 | 1.005 | 0.000 | (0;000) | ✗ | 06/10/16 |
N3Cl | ICSD | 424502 | Cmc2_1 (36) | ✗ | 8 | 44 | 1 | 2.3446 | 2.370 | 0.000 | (0;000) | ✗ | 06/10/16 |
SnS | ICSD | 43409 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.025 | 0.304 | (0;000) | ✔ | 06/10/16 |
SiRu | ICSD | 650618 | P2_13 (198) | ✗ | 8 | 80 | 3 | 28.9579 | 0.291 | 1.000 | (0;000) | ✗ | 06/10/16 |
SO2 | ICSD | 24645 | C2ce (41) | ✗ | 6 | 36 | 1 | 2.7868 | 3.412 | 0.000 | (0;000) | ✗ | 06/10/16 |
BN | ICSD | 41486 | P6_3mc (186) | ✗ | 4 | 16 | 3 | 5.2311 | 8.408 | 0.000 | (0;000) | ✗ | 06/10/16 |
AgN | ICSD | 167874 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.010 | 0.885 | (1;111) | ✔ | 06/10/16 |
SiRh | ICSD | 653588 | P2_1/c (14) | ✔ | 8 | 84 | 3 | 0.0 | 0.703 | 0.033 | (0;000) | ✔ | 27/01/17 |
Rb2Te5 | ICSD | 30734 | C2/m (12) | ✔ | 7 | 48 | 3 | 0.2458 | 0.494 | 0.000 | (0;000) | ✔ | 02/02/17 |
InCl | ICSD | 2432 | Ccm2_1 (36) | ✗ | 4 | 40 | 3 | 1.4416 | 1.525 | 0.000 | (0;000) | ✗ | 06/10/16 |
Rb2Te | ICSD | 55151 | Ccm2_1 (36) | ✗ | 6 | 48 | 2 | 1.9925 | 1.993 | 0.000 | (0;000) | ✗ | 06/10/16 |
Rb2Te | ICSD | 55148 | Cmc2_1 (36) | ✗ | 6 | 48 | 2 | 1.7077 | 1.708 | 0.000 | (0;000) | ✗ | 06/10/16 |
InCl | ICSD | 2431 | Cc2m (40) | ✗ | 4 | 40 | 1 | 1.4421 | 1.528 | 0.000 | (0;000) | ✗ | 06/10/16 |
BN | ICSD | 162883 | P2_1/c (14) | ✔ | 8 | 32 | 2 | 3.1457 | 3.540 | 0.000 | (0;000) | ✗ | 06/10/16 |
Rb2Se3 | ICSD | 14093 | Ccm2_1 (36) | ✗ | 10 | 72 | 1 | 0.7189 | 0.828 | 0.000 | (0;000) | ✗ | 06/10/16 |
RbSb2 | ICSD | 419402 | C2/m (12) | ✔ | 6 | 38 | 1 | 0.3062 | 0.713 | 0.000 | (0;000) | ✔ | 02/02/17 |
ClF | ICSD | 406442 | P2_1/c (14) | ✔ | 8 | 56 | 1 | 2.4667 | 2.494 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbSb | ICSD | 191491 | F-43m (216) | ✗ | 2 | 14 | 1 | 0.0 | 0.000 | 0.134 | (0;000) | ✔ | 06/10/16 |
Te4Pt3 | ICSD | 77983 | C2/m (12) | ✔ | 7 | 54 | 3 | 0.0 | 0.070 | 0.458 | (1;001) | ✔ | 27/01/17 |
CuCl | ICSD | 23988 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3607 | 0.361 | 0.000 | (0;000) | ✔ | 06/10/16 |
BN | ICSD | 162880 | Cc (9) | ✗ | 8 | 32 | 3 | 3.3515 | 4.168 | 0.000 | (0;000) | ✗ | 06/10/16 |
AgI | ICSD | 62789 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 1.1299 | 1.130 | 0.000 | (0;000) | ✗ | 06/10/16 |
HgO | ICSD | 16627 | Im2m (44) | ✗ | 2 | 18 | 3 | 0.0 | 0.002 | 0.206 | (1;000) | ✔ | 04/10/16 |
BaSb3 | ICSD | 49000 | C2/m (12) | ✔ | 8 | 50 | 1 | 0.0 | 0.104 | 0.361 | (1;001) | ✔ | 02/02/17 |
TaAs2 | ICSD | 44069 | C2/m (12) | ✔ | 6 | 46 | 3 | 0.0 | 0.122 | 0.088 | (0;111) | ✔ | 05/01/17 |
TePt | ICSD | 41383 | C2/m (12) | ✔ | 4 | 32 | 2 | 0.0 | 0.077 | 0.748 | (1;111) | ✔ | 06/10/16 |
ZnPo | ICSD | 105771 | F-43m (216) | ✗ | 2 | 28 | 3 | 0.0 | 0.000 | 0.009 | (1;000) | ✔ | 06/10/16 |
CdTe | ICSD | 67862 | P3_121 (152) | ✗ | 6 | 54 | 3 | 0.5051 | 0.741 | 0.000 | (0;000) | ✗ | 06/10/16 |
TiPd | ICSD | 167649 | P2_1/m (11) | ✔ | 4 | 44 | 3 | 0.0 | 0.000 | 0.849 | (0;000) | ✔ | 06/10/16 |