▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
KLi6BiO6 | ICSD | 72840 | R-3m (166) | ✔ | 14 | 78 | 1 | 2.0022 | 2.002 | 0.000 | (0;000) | ✗ | 05/01/17 |
LiYGa4 | ICSD | 98666 | P-6m2 (187) | ✗ | 6 | 66 | 3 | 0.0 | 0.004 | 0.244 | (0;000) | ✔ | 05/12/16 |
Zr4NbGa3 | ICSD | 634794 | I4/mcm (140) | ✔ | 16 | 136 | 3 | 0.0 | 0.001 | 0.724 | (0;000) | ✗ | 02/02/17 |
KBiO2 | COD | 1528047 | C2/c (15) | ✔ | 8 | 72 | 1 | 1.2352 | 1.245 | 0.000 | (0;000) | ✗ | 05/01/17 |
HfGeRu | ICSD | 636584 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.759 | (0;000) | ✔ | 05/12/16 |
Ga3Os | ICSD | 635023 | P4_2/mnm (136) | ✔ | 16 | 220 | 3 | 0.0 | 0.401 | 0.100 | (0;000) | ✗ | 02/02/17 |
MnBi | COD | 9008899 | P6_3/mmc (194) | ✔ | 4 | 60 | 3 | 0.0 | 0.004 | 0.449 | (0;000) | ✗ | 05/01/17 |
NaBiO2 | COD | 8103708 | C2/c (15) | ✔ | 8 | 72 | 3 | 1.311 | 1.317 | 0.000 | (0;000) | ✗ | 05/01/17 |
TiO2 | ICSD | 41493 | P3_121 (152) | ✗ | 9 | 72 | 3 | 3.8185 | 3.903 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ga3Re | ICSD | 635203 | P4_2/mnm (136) | ✔ | 16 | 216 | 3 | 0.0 | 0.065 | 0.104 | (0;000) | ✗ | 02/02/17 |
Ga3Rh | ICSD | 635208 | P4_2/mnm (136) | ✔ | 16 | 224 | 3 | 0.0 | 0.006 | 0.327 | (0;000) | ✗ | 02/02/17 |
Ga3Ru | ICSD | 412078 | P4_2/mnm (136) | ✔ | 16 | 220 | 3 | 0.3066 | 0.673 | 0.000 | (0;000) | ✗ | 02/02/17 |
HfGeTe4 | ICSD | 241122 | Cmc2_1 (36) | ✗ | 12 | 80 | 2 | 0.1165 | 0.169 | 0.000 | (0;000) | ✔ | 06/10/16 |
NaBiO3 | COD | 1526788 | R-3 (148) | ✔ | 10 | 84 | 1 | 1.4476 | 1.542 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ta5Ga3 | ICSD | 635482 | I4/mcm (140) | ✔ | 16 | 208 | 3 | 0.0 | 0.018 | 0.631 | (0;000) | ✗ | 02/02/17 |
Hg2GeSe4 | ICSD | 59911 | I-4 (82) | ✗ | 7 | 52 | 3 | 0.4365 | 0.437 | 0.000 | (0;000) | ✔ | 06/10/16 |
Ta5Ga3 | COD | 1522719 | P6_3/mcm (193) | ✔ | 16 | 208 | 3 | 0.0 | 0.002 | 0.935 | (0;000) | ✗ | 02/02/17 |
InBO3 | COD | 2010257 | R-3c (167) | ✔ | 10 | 68 | 3 | 3.0882 | 3.509 | 0.000 | (0;000) | ✗ | 05/01/17 |
InBO6 | COD | 5910089 | R-3m (166) | ✔ | 8 | 52 | 3 | 0.0 | 0.007 | 0.415 | (0;000) | ✗ | 05/01/17 |
Hg2GeSe4 | ICSD | 636599 | I-4 (82) | ✗ | 7 | 52 | 3 | 0.4485 | 0.449 | 0.000 | (0;000) | ✔ | 06/10/16 |
V5Ga3 | ICSD | 635612 | P6_3/mcm (193) | ✔ | 16 | 208 | 3 | 0.0 | 0.001 | 0.621 | (0;000) | ✗ | 02/02/17 |
Y5Ga3 | ICSD | 635657 | P6_3/mcm (193) | ✔ | 16 | 188 | 3 | 0.0 | 0.001 | 0.431 | (0;000) | ✗ | 02/02/17 |
BiO2 | COD | 9009765 | C2/c (15) | ✔ | 12 | 108 | 3 | 1.529 | 1.615 | 0.000 | (0;000) | ✗ | 05/01/17 |
Nb5Ga4 | COD | 1523473 | P6_3/mcm (193) | ✔ | 18 | 234 | 3 | 0.0 | 0.000 | 0.478 | (0;000) | ✗ | 02/02/17 |
RbBiO2 | ICSD | 407208 | C2/c (15) | ✔ | 8 | 72 | 1 | 2.0422 | 2.042 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ti5Ga4 | COD | 1522851 | P6_3/mcm (193) | ✔ | 18 | 224 | 3 | 0.0 | 0.001 | 0.619 | (0;000) | ✗ | 02/02/17 |
Bi(PdO2)2 | ICSD | 263051 | P-1 (2) | ✔ | 14 | 150 | 3 | 0.0 | 0.134 | 0.105 | (0;000) | ✗ | 05/01/17 |
CsPbCl3 | COD | 1530111 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 0.6886 | 0.689 | 0.000 | (0;000) | ✗ | 27/01/17 |
OsO4 | ICSD | 24672 | C2 (5) | ✗ | 5 | 40 | 1 | 4.2187 | 4.251 | 0.000 | (0;000) | ✗ | 06/10/16 |
Hg2GeSe4 | ICSD | 96180 | I-4 (82) | ✗ | 7 | 52 | 3 | 0.4544 | 0.454 | 0.000 | (0;000) | ✔ | 06/10/16 |
BiPO4 | COD | 7023720 | P2_1/m (11) | ✔ | 12 | 88 | 3 | 3.4763 | 3.555 | 0.000 | (0;000) | ✗ | 05/01/17 |
ReBiO4 | COD | 1522924 | Cmcm (63) | ✔ | 12 | 108 | 3 | 0.0 | 0.030 | 0.756 | (0;000) | ✗ | 05/01/17 |
BiSbO4 | ICSD | 35478 | C2/c (15) | ✔ | 12 | 88 | 3 | 2.6573 | 2.690 | 0.000 | (0;000) | ✗ | 05/01/17 |
Zr3Ga5 | ICSD | 635697 | Cmcm (63) | ✔ | 16 | 154 | 3 | 0.0 | 0.000 | 0.688 | (0;000) | ✗ | 02/02/17 |
VBiO4 | COD | 9011741 | I4_1/amd (141) | ✔ | 12 | 104 | 3 | 2.5386 | 2.543 | 0.000 | (0;000) | ✗ | 05/01/17 |
MoN | ICSD | 76280 | P6_3/mmc (194) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.939 | (0;000) | ✗ | 06/10/16 |
VBiO4 | COD | 9012062 | I4_1/a (88) | ✔ | 12 | 104 | 3 | 2.1086 | 2.165 | 0.000 | (0;000) | ✗ | 05/01/17 |
Li2GeO3 | ICSD | 100403 | Ccm2_1 (36) | ✗ | 12 | 56 | 1 | 4.0511 | 4.230 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsHgCl3 | COD | 1010121 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.397 | 0.385 | (0;000) | ✗ | 27/01/17 |
CdP4 | ICSD | 25605 | P2_1/c (14) | ✔ | 10 | 64 | 2 | 0.4602 | 0.528 | 0.000 | (0;000) | ✔ | 06/10/16 |
Y3Ga8Rh3 | ICSD | 635222 | Immm (71) | ✔ | 14 | 188 | 3 | 0.0 | 0.010 | 0.710 | (0;000) | ✗ | 02/02/17 |
Rb3Bi | ICSD | 616996 | Fm-3m (225) | ✔ | 4 | 42 | 1 | 0.0996 | 0.410 | 0.000 | (0;000) | ✗ | 05/01/17 |
Na5GaGe2 | ICSD | 169702 | P2_1/m (11) | ✔ | 16 | 132 | 1 | 0.0 | 0.506 | 0.077 | (0;000) | ✗ | 02/02/17 |
Sr2GaGeN | ICSD | 420413 | P2_1/m (11) | ✔ | 10 | 84 | 1 | 0.0 | 0.566 | 0.036 | (0;000) | ✗ | 02/02/17 |
SrGaGe | ICSD | 634281 | P6_3/mmc (194) | ✔ | 12 | 108 | 1 | 0.0 | 0.026 | 0.816 | (0;000) | ✗ | 02/02/17 |
GaI3 | ICSD | 413457 | P2_1/c (14) | ✔ | 16 | 136 | 1 | 1.9315 | 1.958 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiGaI3 | COD | 1530097 | P2_1/m (11) | ✔ | 20 | 148 | 1 | 2.2566 | 2.316 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbBiS2 | ICSD | 52735 | R-3m (166) | ✔ | 4 | 36 | 2 | 1.0427 | 1.171 | 0.000 | (0;000) | ✗ | 05/01/17 |
InGaTe2 | ICSD | 60084 | I4/mcm (140) | ✔ | 8 | 76 | 3 | 0.0 | 0.076 | 0.065 | (0;000) | ✗ | 02/02/17 |
AgBr | ICSD | 56549 | P2_1/m (11) | ✔ | 4 | 36 | 3 | 0.3803 | 1.889 | 0.000 | (0;000) | ✔ | 06/10/16 |