▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NaI(OF)2 | COD | 2016692 | Cmcm (63) | ✔ | 12 | 84 | 1 | 4.7043 | 4.786 | 0.000 | (0;000) | ✗ | 22/03/17 |
LiYF2 | COD | 2001129 | I4_1/a (88) | ✔ | 16 | 112 | 3 | 0.0 | 0.010 | 0.659 | (1;111) | ✗ | 22/03/17 |
NF2 | COD | 9016398 | Pmna (53) | ✔ | 12 | 76 | 1 | 0.0 | 0.004 | 0.376 | (1;011) | ✗ | 22/03/17 |
CO2 | ICSD | 188893 | Cmce (64) | ✔ | 6 | 32 | 1 | 0.8836 | 1.332 | 0.000 | (0;000) | ✗ | 27/01/17 |
AlCuPt2 | ICSD | 107788 | P4/mmm (123) | ✔ | 4 | 34 | 3 | 0.0 | 0.101 | 0.248 | (1;111) | ✗ | 05/01/17 |
Sr2Ti2Sb2OF2 | ICSD | 167014 | I4/mmm (139) | ✔ | 9 | 74 | 1 | 0.0 | 0.022 | 0.576 | (0;000) | ✗ | 22/03/17 |
AlH2PbO2F3 | ICSD | 79740 | P-1 (2) | ✔ | 18 | 104 | 2 | 4.138 | 4.338 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cr3Rh | ICSD | 626569 | Pm-3n (223) | ✔ | 8 | 118 | 3 | 0.0 | 0.000 | 0.741 | (0;000) | ✗ | 27/01/17 |
AlF3 | ICSD | 130021 | Pm-3m (221) | ✔ | 4 | 24 | 3 | 7.6687 | 8.500 | 0.000 | (0;000) | ✗ | 05/01/17 |
AlF3 | COD | 1000467 | R-3c (167) | ✔ | 8 | 48 | 3 | 8.0575 | 8.058 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cr3Se4 | COD | 1008921 | C2/m (12) | ✔ | 7 | 66 | 3 | 0.0 | 0.004 | 0.716 | (0;001) | ✗ | 27/01/17 |
BiSe | ICSD | 20458 | P-3m1 (164) | ✔ | 12 | 66 | 2 | 0.0 | 0.063 | 0.011 | (0;001) | ✗ | 06/10/16 |
KAlF4 | ICSD | 77913 | P4/mmm (123) | ✔ | 6 | 40 | 2 | 7.3093 | 7.704 | 0.000 | (0;000) | ✗ | 05/01/17 |
KAlF4 | COD | 1000207 | P4/mbm (127) | ✔ | 12 | 80 | 2 | 7.2718 | 7.309 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cr3S4 | COD | 9007442 | C2/m (12) | ✔ | 7 | 66 | 3 | 0.0 | 0.005 | 0.538 | (0;001) | ✗ | 27/01/17 |
NaAlF4 | ICSD | 20572 | P4/mmm (123) | ✔ | 6 | 40 | 2 | 6.0733 | 6.404 | 0.000 | (0;000) | ✗ | 05/01/17 |
NaAlF4 | COD | 1507767 | Cmcm (63) | ✔ | 12 | 80 | 1 | 6.625 | 6.625 | 0.000 | (0;000) | ✗ | 05/01/17 |
Li2MnF5 | COD | 1530560 | C2/c (15) | ✔ | 16 | 112 | 1 | 0.0 | 0.019 | 0.219 | (0;000) | ✗ | 22/03/17 |
CrCuO4 | ICSD | 183216 | Cmcm (63) | ✔ | 12 | 98 | 3 | 0.0 | 0.000 | 0.580 | (0;000) | ✗ | 27/01/17 |
Rb2LiFeF6 | ICSD | 16400 | R-3m (166) | ✔ | 20 | 142 | 1 | 0.0 | 0.021 | 0.178 | (0;000) | ✗ | 22/03/17 |
Cr3Te4 | ICSD | 626884 | C2/m (12) | ✔ | 7 | 66 | 3 | 0.0 | 0.009 | 0.299 | (0;000) | ✗ | 27/01/17 |
Bi2Se3 | ICSD | 165226 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.2932 | 0.375 | 0.000 | (1;000) | ✗ | 06/10/16 |
AlNF4 | COD | 9016185 | I4/mcm (140) | ✔ | 12 | 72 | 2 | 0.0 | 0.002 | 0.137 | (0;000) | ✗ | 05/01/17 |
RbAlF4 | COD | 1000453 | P4/mmm (123) | ✔ | 6 | 40 | 2 | 7.1638 | 7.596 | 0.000 | (0;000) | ✗ | 05/01/17 |
Sr3(FeO3)2 | ICSD | 249014 | I4/mmm (139) | ✔ | 11 | 82 | 1 | 0.0 | 0.008 | 0.799 | (1;111) | ✗ | 22/03/17 |