▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Li2TiGeO5 | ICSD | 250297 | P4/nmm (129) | ✔ | 18 | 104 | 2 | 3.6252 | 3.899 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiGeTe2 | ICSD | 35676 | P-1 (2) | ✔ | 24 | 114 | 1 | 0.3298 | 0.525 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na2GeS3 | ICSD | 653637 | P2_1/c (14) | ✔ | 24 | 160 | 1 | 2.7259 | 2.726 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na2GeSe3 | ICSD | 49003 | P2_1/c (14) | ✔ | 24 | 160 | 1 | 1.7979 | 1.798 | 0.000 | (0;000) | ✗ | 04/08/17 |
GeTeRh | ICSD | 260373 | Pbca (61) | ✔ | 24 | 216 | 3 | 0.2684 | 0.277 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li3As | COD | 1010288 | P6_3/mmc (194) | ✔ | 8 | 28 | 1 | 0.7732 | 1.714 | 0.000 | (0;000) | ✗ | 05/01/17 |
MgP4 | ICSD | 113 | P2_1/c (14) | ✔ | 10 | 60 | 1 | 0.6744 | 0.674 | 0.000 | (0;000) | ✗ | 06/10/16 |
MgH2 | ICSD | 155811 | Pbca (61) | ✔ | 24 | 96 | 1 | 2.3202 | 2.320 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiMnAs | ICSD | 26459 | P4/nmm (129) | ✔ | 6 | 46 | 2 | 0.0 | 0.000 | 0.824 | (0;001) | ✗ | 05/01/17 |
Ti3H2O7 | COD | 4336945 | C2/m (12) | ✔ | 24 | 160 | 3 | 1.9314 | 1.964 | 0.000 | (0;000) | ✗ | 04/08/17 |
H2O | COD | 1011024 | Ibam (72) | ✔ | 24 | 64 | 2 | 0.0 | 0.002 | 0.187 | (0;000) | ✗ | 04/08/17 |
KH3O2 | ICSD | 47114 | P2_1/c (14) | ✔ | 24 | 96 | 1 | 4.2058 | 4.232 | 0.000 | (0;000) | ✗ | 04/08/17 |
YH3 | ICSD | 154809 | P-3c1 (165) | ✔ | 24 | 84 | 3 | 0.0 | 0.037 | 0.008 | (1;000) | ✗ | 04/08/17 |
Li4H6Os | ICSD | 638269 | R-3c (167) | ✔ | 22 | 68 | 1 | 2.3096 | 2.310 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li4RuH6 | ICSD | 638272 | R-3c (167) | ✔ | 22 | 68 | 1 | 2.2498 | 2.250 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na4RuH6 | ICSD | 638362 | R-3c (167) | ✔ | 22 | 116 | 1 | 1.6539 | 1.654 | 0.000 | (0;000) | ✗ | 04/08/17 |
H7O4 | COD | 9015632 | Ibam (72) | ✔ | 22 | 62 | 2 | 0.0 | 0.000 | 0.810 | (1;111) | ✗ | 04/08/17 |
LiAsO3 | COD | 1529820 | R-3 (148) | ✔ | 10 | 52 | 1 | 4.0057 | 4.210 | 0.000 | (0;000) | ✗ | 05/01/17 |
Mg5H8O9 | COD | 1531175 | P-3m1 (164) | ✔ | 22 | 112 | 1 | 3.7257 | 3.726 | 0.000 | (0;000) | ✗ | 04/08/17 |
HfMo2 | ICSD | 638615 | P6_3/mmc (194) | ✔ | 24 | 320 | 3 | 0.0 | 0.006 | 0.930 | (0;000) | ✗ | 04/08/17 |
HfO2 | ICSD | 79913 | Pbca (61) | ✔ | 24 | 192 | 3 | 4.3367 | 4.480 | 0.000 | (0;000) | ✗ | 04/08/17 |
HfSb2 | ICSD | 66780 | Pnnm (58) | ✔ | 24 | 176 | 3 | 0.0 | 0.043 | 0.303 | (0;000) | ✗ | 04/08/17 |
HfZn2 | ICSD | 639018 | P6_3/mmc (194) | ✔ | 24 | 288 | 3 | 0.0 | 0.002 | 0.871 | (1;000) | ✗ | 04/08/17 |
Hg2SeO3 | ICSD | 412302 | P2_1/c (14) | ✔ | 24 | 192 | 3 | 2.3056 | 2.306 | 0.000 | (0;000) | ✗ | 04/08/17 |
Sr2YTlCu2O7 | ICSD | 74164 | P4/mmm (123) | ✔ | 13 | 108 | 3 | 0.0 | 0.012 | 0.953 | (1;111) | ✗ | 27/01/17 |
Hg2SeO3 | ICSD | 412304 | Ibam (72) | ✔ | 24 | 192 | 3 | 2.4767 | 2.477 | 0.000 | (0;000) | ✗ | 04/08/17 |
Hg3Se4O5 | COD | 7005928 | P-1 (2) | ✔ | 24 | 180 | 3 | 1.9543 | 2.141 | 0.000 | (0;000) | ✗ | 04/08/17 |
HgI2 | COD | 2103470 | P4_2/nmc (137) | ✔ | 24 | 208 | 3 | 1.0894 | 1.089 | 0.000 | (0;000) | ✗ | 04/08/17 |
HgI2 | COD | 9008155 | I4_1/amd (141) | ✔ | 24 | 208 | 3 | 1.2969 | 1.297 | 0.000 | (0;000) | ✗ | 04/08/17 |
MgCl2 | ICSD | 51247 | P-1 (2) | ✔ | 6 | 48 | 3 | 2.4906 | 2.491 | 0.000 | (0;000) | ✗ | 06/10/16 |
HgPO4 | COD | 9008252 | P2_1/c (14) | ✔ | 24 | 164 | 2 | 0.0 | 0.006 | 0.481 | (1;000) | ✗ | 04/08/17 |
ReHgO4 | ICSD | 74885 | P2_1/c (14) | ✔ | 24 | 204 | 3 | 3.022 | 3.022 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiHS | COD | 1532751 | P4_2/mbc (135) | ✔ | 24 | 80 | 1 | 3.5998 | 3.600 | 0.000 | (0;000) | ✗ | 04/08/17 |
InI2 | ICSD | 201607 | Pnna (52) | ✔ | 24 | 216 | 1 | 1.6982 | 1.707 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiAsSe2 | COD | 4102048 | P-1 (2) | ✔ | 8 | 40 | 1 | 0.0 | 0.097 | 0.008 | (0;000) | ✗ | 05/01/17 |
SrI2 | COD | 9008163 | Pbca (61) | ✔ | 24 | 192 | 1 | 3.674 | 3.674 | 0.000 | (0;000) | ✗ | 04/08/17 |
NaMgAs | COD | 9008321 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 0.9367 | 0.937 | 0.000 | (0;000) | ✗ | 05/01/17 |
ReI3 | ICSD | 25114 | P2_1/m (11) | ✔ | 24 | 216 | 2 | 0.7756 | 0.780 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiInI4 | ICSD | 36599 | P2_1/c (14) | ✔ | 24 | 176 | 1 | 2.0709 | 2.071 | 0.000 | (0;000) | ✗ | 04/08/17 |
NaInI4 | ICSD | 65463 | P2_1/c (14) | ✔ | 24 | 200 | 1 | 2.2385 | 2.239 | 0.000 | (0;000) | ✗ | 04/08/17 |
NbI5 | ICSD | 25503 | P2_1/c (14) | ✔ | 24 | 192 | 1 | 0.0 | 0.045 | 0.106 | (0;000) | ✗ | 04/08/17 |
Cu2P2O7 | ICSD | 27436 | C2/m (12) | ✔ | 11 | 74 | 3 | 0.0 | 0.008 | 0.529 | (0;000) | ✗ | 27/01/17 |
LiIO4 | ICSD | 400552 | P2_1/c (14) | ✔ | 24 | 136 | 1 | 2.6356 | 2.723 | 0.000 | (0;000) | ✗ | 04/08/17 |
YIn2Ni9 | ICSD | 192651 | P4/mbm (127) | ✔ | 24 | 254 | 3 | 0.0 | 0.000 | 0.798 | (1;110) | ✗ | 04/08/17 |
In2Si2O7 | COD | 1527984 | Fd-3m (227) | ✔ | 22 | 152 | 3 | 2.1883 | 2.640 | 0.000 | (0;000) | ✗ | 04/08/17 |
In2Sn3S7 | ICSD | 68366 | P2_1/m (11) | ✔ | 24 | 220 | 3 | 0.0 | 0.197 | 0.102 | (0;000) | ✗ | 04/08/17 |
In2Se | ICSD | 44646 | Pnnm (58) | ✔ | 24 | 256 | 3 | 0.0 | 0.003 | 0.830 | (1;000) | ✗ | 04/08/17 |
In2Te | ICSD | 640618 | Pnnm (58) | ✔ | 24 | 256 | 3 | 0.0 | 0.019 | 0.909 | (1;000) | ✗ | 04/08/17 |
TlIn5S6 | ICSD | 56388 | P2_1/m (11) | ✔ | 24 | 228 | 3 | 1.0914 | 1.183 | 0.000 | (0;000) | ✗ | 04/08/17 |
Y11In9Ni4 | ICSD | 167637 | Cmmm (65) | ✔ | 24 | 278 | 3 | 0.0 | 0.008 | 0.922 | (0;001) | ✗ | 04/08/17 |