▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BiPO4 | ICSD | 27469 | P2_1 (4) | ✗ | 12 | 68 | 3 | 2.0944 | 2.399 | 0.000 | (0;000) | ✗ | 06/10/16 |
CdC | ICSD | 183178 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.000 | 0.842 | (0;000) | ✔ | 06/10/16 |
KSb2 | ICSD | 80945 | C2/m (12) | ✔ | 6 | 38 | 1 | 0.1801 | 0.569 | 0.000 | (0;000) | ✔ | 02/02/17 |
TaCu3Te4 | ICSD | 80282 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.0131 | 1.581 | 0.000 | (0;000) | ✗ | 06/10/16 |
KNbO3 | ICSD | 190922 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.1224 | 2.960 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd2P3Br | ICSD | 100817 | Cc (9) | ✗ | 12 | 92 | 3 | 1.0294 | 1.383 | 0.000 | (0;000) | ✗ | 06/10/16 |
HgIBr | ICSD | 109010 | Ccm2_1 (36) | ✗ | 6 | 52 | 2 | 1.3842 | 1.389 | 0.000 | (0;000) | ✗ | 06/10/16 |
KBrO3 | ICSD | 33663 | R3m (160) | ✗ | 5 | 34 | 1 | 3.1451 | 3.145 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiNbO3 | ICSD | 169695 | R3c (161) | ✗ | 10 | 68 | 3 | 3.429 | 3.550 | 0.000 | (0;000) | ✗ | 06/10/16 |
KBrO3 | ICSD | 74767 | R3m (160) | ✗ | 5 | 34 | 1 | 3.8919 | 3.892 | 0.000 | (0;000) | ✗ | 06/10/16 |
RbBrO3 | ICSD | 74768 | R3m (160) | ✗ | 5 | 34 | 1 | 4.0343 | 4.035 | 0.000 | (0;000) | ✗ | 06/10/16 |
TlBrO3 | ICSD | 76966 | R3m (160) | ✗ | 5 | 38 | 1 | 2.7769 | 2.778 | 0.000 | (0;000) | ✗ | 06/10/16 |
SbSBr | ICSD | 88587 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.6228 | 1.792 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZnCd3S4 | ICSD | 169187 | P-43m (215) | ✗ | 8 | 72 | 3 | 1.364 | 1.364 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiNbO3 | ICSD | 169696 | R3c (161) | ✗ | 10 | 68 | 3 | 3.0848 | 3.185 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaGa | ICSD | 260641 | Ccmm (63) | ✔ | 4 | 46 | 1 | 0.0 | 0.000 | 0.830 | (0;000) | ✗ | 06/10/16 |
TaCu3Se4 | ICSD | 156981 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.5486 | 1.963 | 0.000 | (0;000) | ✗ | 06/10/16 |
TaCu3Se4 | ICSD | 427174 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.5807 | 2.033 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaC2 | ICSD | 74665 | I4/mmm (139) | ✔ | 3 | 18 | 1 | 1.6401 | 2.615 | 0.000 | (0;000) | ✗ | 06/10/16 |
Li2S | ICSD | 91283 | P2_1nb (33) | ✗ | 12 | 48 | 1 | 2.808 | 3.650 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaC2 | ICSD | 66663 | P-1 (2) | ✔ | 6 | 36 | 1 | 2.4633 | 3.084 | 0.000 | (0;000) | ✗ | 06/10/16 |
Nb3SBr7 | ICSD | 81078 | P3m1 (156) | ✗ | 11 | 94 | 2 | 0.7653 | 0.766 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ta3SBr7 | ICSD | 51101 | Cm (8) | ✗ | 11 | 94 | 2 | 0.7877 | 0.789 | 0.000 | (0;000) | ✗ | 06/10/16 |
AgCN | ICSD | 85783 | R3m (160) | ✗ | 3 | 20 | 1 | 2.5177 | 3.110 | 0.000 | (0;000) | ✗ | 06/10/16 |
RhBr3 | ICSD | 28245 | C2/m (12) | ✔ | 8 | 76 | 2 | 1.23 | 1.361 | 0.000 | (0;000) | ✗ | 02/02/17 |
AuCN | ICSD | 165175 | P6mm (183) | ✗ | 3 | 20 | 3 | 0.9094 | 1.164 | 0.000 | (0;000) | ✗ | 06/10/16 |
AuCN | ICSD | 85782 | P6mm (183) | ✗ | 3 | 20 | 3 | 0.0 | 0.999 | 0.053 | (0;000) | ✔ | 06/10/16 |
Rb4CO4 | ICSD | 245437 | R3 (146) | ✗ | 9 | 64 | 3 | 2.8509 | 2.870 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaCO3 | ICSD | 158389 | R3m (160) | ✗ | 5 | 32 | 1 | 3.7206 | 3.786 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaCO3 | ICSD | 158390 | R3m (160) | ✗ | 5 | 32 | 1 | 3.7237 | 3.789 | 0.000 | (0;000) | ✗ | 06/10/16 |
Na2Cl | ICSD | 190546 | Cmmm (65) | ✔ | 6 | 50 | 3 | 0.0 | 0.508 | 0.159 | (0;000) | ✗ | 06/10/16 |
CaCO3 | ICSD | 161820 | C222_1 (20) | ✗ | 10 | 64 | 3 | 5.1926 | 5.193 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaCO3 | ICSD | 180348 | R-3c (167) | ✔ | 10 | 64 | 2 | 5.0647 | 5.184 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaCO3 | ICSD | 180349 | R-3c (167) | ✔ | 10 | 64 | 2 | 5.1604 | 5.214 | 0.000 | (0;000) | ✗ | 06/10/16 |
CdCN2 | ICSD | 95265 | R3m (160) | ✗ | 4 | 26 | 3 | 2.021 | 2.021 | 0.000 | (0;000) | ✗ | 06/10/16 |
CClF3 | ICSD | 49696 | Ccm2_1 (36) | ✗ | 10 | 64 | 1 | 6.6335 | 6.643 | 0.000 | (0;000) | ✗ | 06/10/16 |
C(ClF)2 | ICSD | 33946 | F2dd (43) | ✗ | 10 | 64 | 1 | 5.5318 | 5.537 | 0.000 | (0;000) | ✗ | 06/10/16 |
C(ClF)2 | ICSD | 33947 | F2dd (43) | ✗ | 10 | 64 | 1 | 5.63 | 5.635 | 0.000 | (0;000) | ✗ | 06/10/16 |
C(ClF)2 | ICSD | 33948 | F2dd (43) | ✗ | 10 | 64 | 1 | 5.7375 | 5.742 | 0.000 | (0;000) | ✗ | 06/10/16 |
CIN | ICSD | 77911 | R3m (160) | ✗ | 3 | 16 | 1 | 3.8512 | 3.926 | 0.000 | (0;000) | ✗ | 06/10/16 |
KCN | ICSD | 173942 | Cc (9) | ✗ | 6 | 36 | 1 | 5.131 | 5.273 | 0.000 | (0;000) | ✗ | 06/10/16 |
KCN | ICSD | 27350 | Cm (8) | ✗ | 3 | 18 | 1 | 4.9473 | 5.716 | 0.000 | (0;000) | ✗ | 06/10/16 |
KCN | ICSD | 27351 | Cm (8) | ✗ | 3 | 18 | 1 | 4.6894 | 5.539 | 0.000 | (0;000) | ✗ | 06/10/16 |
KCN | ICSD | 27352 | Cm (8) | ✗ | 3 | 18 | 1 | 5.6021 | 6.193 | 0.000 | (0;000) | ✗ | 06/10/16 |
K4CO4 | ICSD | 245417 | P-43m (215) | ✗ | 9 | 64 | 3 | 2.878 | 2.878 | 0.000 | (0;000) | ✗ | 06/10/16 |
K4CO4 | ICSD | 245418 | R3m (160) | ✗ | 9 | 64 | 3 | 2.2834 | 2.355 | 0.000 | (0;000) | ✗ | 06/10/16 |
K4CO4 | ICSD | 245421 | Cm (8) | ✗ | 9 | 64 | 3 | 0.521 | 0.796 | 0.000 | (0;000) | ✗ | 06/10/16 |
K4CO4 | ICSD | 245422 | C2 (5) | ✗ | 9 | 64 | 2 | 2.3193 | 2.486 | 0.000 | (0;000) | ✗ | 06/10/16 |
K4CO4 | ICSD | 245423 | R3 (146) | ✗ | 9 | 64 | 3 | 3.2247 | 3.274 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ge2N2O | ICSD | 200849 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.2545 | 2.593 | 0.000 | (0;000) | ✗ | 06/10/16 |