▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
SnH8(NCl3)2 | COD | 9013381 | Fm-3m (225) | ✔ | 17 | 74 | 1 | 2.5738 | 2.574 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsWCl6 | COD | 1527332 | C2/c (15) | ✔ | 16 | 130 | 1 | 0.0 | 0.002 | 0.475 | (1;010) | ✗ | 02/02/17 |
CaNi4B | COD | 8103479 | P6/mmm (191) | ✔ | 12 | 106 | 3 | 0.0 | 0.001 | 0.746 | (1;000) | ✗ | 05/01/17 |
Ca3BN3 | COD | 1511018 | P4/mmm (123) | ✔ | 7 | 48 | 1 | 0.4803 | 0.491 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cs2SnCl6 | COD | 1010228 | Fm-3m (225) | ✔ | 9 | 74 | 1 | 2.8166 | 2.817 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2SeCl6 | COD | 1010222 | Fm-3m (225) | ✔ | 9 | 66 | 1 | 2.598 | 2.786 | 0.000 | (0;000) | ✗ | 02/02/17 |
Be4B | COD | 1511458 | P4/nmm (129) | ✔ | 10 | 38 | 1 | 0.0 | 0.000 | 0.827 | (0;001) | ✗ | 05/01/17 |
Cs2MoCl6 | COD | 8102884 | Fm-3m (225) | ✔ | 9 | 74 | 1 | 0.0 | 0.000 | 0.190 | (0;000) | ✗ | 02/02/17 |
BaNaBO3 | COD | 2003991 | C2/m (12) | ✔ | 12 | 80 | 1 | 3.8607 | 3.861 | 0.000 | (0;000) | ✗ | 05/01/17 |
MoCl5 | COD | 2101942 | P-1 (2) | ✔ | 12 | 98 | 1 | 0.0 | 0.004 | 0.377 | (1;111) | ✗ | 02/02/17 |
Cs3CoCl5 | COD | 2011750 | I4/mcm (140) | ✔ | 18 | 158 | 1 | 0.0 | 0.000 | 0.321 | (0;111) | ✗ | 02/02/17 |
ReCl4 | COD | 4123951 | P2/c (13) | ✔ | 20 | 172 | 1 | 0.0 | 0.032 | 0.088 | (0;000) | ✗ | 02/02/17 |
BaTe | COD | 9008602 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 1.2448 | 1.616 | 0.000 | (0;000) | ✗ | 05/01/17 |
PbCl4 | COD | 9007926 | C2/c (15) | ✔ | 10 | 84 | 1 | 2.1044 | 2.104 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaS | COD | 9008600 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 2.0979 | 2.188 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaZnSn | COD | 1527804 | P6_3/mmc (194) | ✔ | 6 | 72 | 2 | 0.0 | 0.002 | 0.266 | (1;000) | ✗ | 05/01/17 |
Pd(NCl2)2 | COD | 9015430 | P4/mmm (123) | ✔ | 7 | 56 | 1 | 0.0 | 0.001 | 0.522 | (0;000) | ✗ | 02/02/17 |
BaZnSi | COD | 1527803 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.001 | 0.295 | (0;000) | ✗ | 05/01/17 |
BaSi | COD | 1526652 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.012 | 0.130 | (0;110) | ✗ | 05/01/17 |
K2PtCl4 | COD | 1010083 | P4/mmm (123) | ✔ | 7 | 56 | 1 | 1.5056 | 1.537 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaSi2 | COD | 1527353 | P-3m1 (164) | ✔ | 3 | 18 | 2 | 0.0 | 0.020 | 0.229 | (0;001) | ✗ | 05/01/17 |
BaSe | COD | 9008601 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 1.7784 | 1.971 | 0.000 | (0;000) | ✗ | 05/01/17 |
Rb2CuCl4 | COD | 1528214 | Cmce (64) | ✔ | 14 | 114 | 2 | 0.0 | 0.000 | 0.938 | (0;000) | ✗ | 02/02/17 |
BaSe2 | COD | 7221479 | C2/c (15) | ✔ | 6 | 44 | 1 | 1.009 | 1.076 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cs2PtCl4 | COD | 9009288 | Cmcm (63) | ✔ | 14 | 112 | 1 | 1.8445 | 1.845 | 0.000 | (0;000) | ✗ | 02/02/17 |