▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
InAs | ICSD | 165462 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.009 | (1;000) | ✔ | 06/10/16 |
InP | ICSD | 165466 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3939 | 0.394 | 0.000 | (0;000) | ✔ | 06/10/16 |
Ca3SnH2 | ICSD | 165615 | Cmcm (63) | ✔ | 12 | 92 | 1 | 0.133 | 0.133 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca3H2Pb | ICSD | 165616 | Cmcm (63) | ✔ | 12 | 92 | 1 | 0.0 | 0.005 | 0.020 | (0;000) | ✗ | 02/02/17 |
Hg(C2F3)2 | ICSD | 165635 | P-1 (2) | ✔ | 11 | 70 | 1 | 3.4881 | 3.797 | 0.000 | (0;000) | ✗ | 27/01/17 |
YGa3Ni2 | ICSD | 165660 | P6/mmm (191) | ✔ | 18 | 210 | 3 | 0.0 | 0.002 | 0.920 | (1;001) | ✗ | 02/02/17 |
CaRuO3 | ICSD | 165689 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.0 | 0.015 | 0.253 | (0;000) | ✗ | 22/03/17 |
Ga5Ni | ICSD | 165723 | I4/mcm (140) | ✔ | 12 | 150 | 3 | 0.0 | 0.001 | 0.474 | (1;000) | ✗ | 27/01/17 |
Sr(NiGe)2 | ICSD | 165736 | I4/mmm (139) | ✔ | 5 | 38 | 3 | 0.0 | 0.007 | 0.715 | (0;111) | ✗ | 27/01/17 |
Sr(GeIr)2 | ICSD | 165737 | I4/mmm (139) | ✔ | 5 | 52 | 3 | 0.0 | 0.043 | 0.561 | (1;111) | ✗ | 27/01/17 |
AlCuS2 | ICSD | 165738 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.9307 | 1.931 | 0.000 | (0;000) | ✗ | 07/10/16 |
AlCuSe2 | ICSD | 165740 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.3029 | 1.303 | 0.000 | (0;000) | ✗ | 07/10/16 |
AlCuTe2 | ICSD | 165742 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.002 | 1.002 | 0.000 | (0;000) | ✗ | 07/10/16 |
Sr4S3O | ICSD | 165967 | Pm-3m (221) | ✔ | 8 | 64 | 1 | 2.1198 | 2.120 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr2SO | ICSD | 165968 | P4/mmm (123) | ✔ | 4 | 32 | 1 | 2.1939 | 2.194 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr4SO3 | ICSD | 165969 | Pm-3m (221) | ✔ | 8 | 64 | 1 | 2.6881 | 2.688 | 0.000 | (0;000) | ✗ | 06/10/16 |
Na3N | ICSD | 165989 | P6/mmm (191) | ✔ | 4 | 32 | 1 | 0.0 | 0.002 | 0.065 | (1;000) | ✗ | 27/01/17 |
Na3N | ICSD | 165991 | Pnma (62) | ✔ | 16 | 128 | 1 | 0.0 | 0.009 | 0.031 | (1;000) | ✗ | 02/02/17 |
Na3N | ICSD | 165994 | Fm-3m (225) | ✔ | 4 | 32 | 3 | 2.0516 | 2.052 | 0.000 | (0;000) | ✗ | 27/01/17 |
K | ICSD | 165996 | Pnma (62) | ✔ | 8 | 72 | 3 | 0.0 | 0.147 | 0.288 | (0;000) | ✗ | 27/01/17 |
Ga2O3 | ICSD | 166198 | C2/m (12) | ✔ | 10 | 88 | 3 | 2.4727 | 2.475 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaSnF4 | ICSD | 166207 | P4/nmm (129) | ✔ | 12 | 104 | 1 | 3.6554 | 3.729 | 0.000 | (0;000) | ✗ | 02/02/17 |
TiH2 | ICSD | 166235 | Fm-3m (225) | ✔ | 3 | 14 | 3 | 0.0 | 0.016 | 0.315 | (1;000) | ✗ | 27/01/17 |
MgO | ICSD | 166273 | P-6m2 (187) | ✗ | 2 | 16 | 3 | 2.2858 | 2.517 | 0.000 | (0;000) | ✗ | 06/10/16 |
P2Pd | ICSD | 166275 | C2/c (15) | ✔ | 6 | 56 | 3 | 0.0 | 0.287 | 0.015 | (0;000) | ✔ | 27/01/17 |
CaGaGe | ICSD | 166384 | P6_3/mmc (194) | ✔ | 12 | 108 | 1 | 0.0 | 0.046 | 0.444 | (0;000) | ✗ | 02/02/17 |
FeSe | ICSD | 166445 | Pnma (62) | ✔ | 8 | 56 | 3 | 0.0 | 0.025 | 0.326 | (1;000) | ✗ | 27/01/17 |
NaBH4 | ICSD | 166446 | Pnma (62) | ✔ | 24 | 64 | 1 | 6.1844 | 6.186 | 0.000 | (0;000) | ✗ | 04/08/17 |
AuN2 | ICSD | 166465 | Pmnn (58) | ✔ | 6 | 42 | 2 | 0.0 | 0.000 | 0.791 | (0;101) | ✗ | 06/10/16 |
Ta5N6 | ICSD | 166512 | P6_3/mcm (193) | ✔ | 22 | 190 | 3 | 0.0 | 0.000 | 0.755 | (0;000) | ✗ | 04/08/17 |
Ca(BC)2 | ICSD | 166515 | P4_2/mmc (131) | ✔ | 10 | 48 | 2 | 0.0 | 0.003 | 0.249 | (1;000) | ✗ | 27/01/17 |
Ca2AsI | ICSD | 166534 | R-3m (166) | ✔ | 4 | 32 | 1 | 0.0 | 0.154 | 0.207 | (0;000) | ✗ | 21/03/17 |
K3AlO3 | ICSD | 166540 | C2/m (12) | ✔ | 14 | 96 | 1 | 2.8531 | 2.861 | 0.000 | (0;000) | ✗ | 30/01/17 |
BC5 | ICSD | 166556 | P-1 (2) | ✔ | 12 | 46 | 3 | 0.0 | 0.084 | 0.417 | (1;110) | ✗ | 06/10/16 |
Cu2S | ICSD | 166578 | P6_3/mmc (194) | ✔ | 6 | 56 | 3 | 0.0 | 0.031 | 0.151 | (0;000) | ✗ | 27/01/17 |
TiSi | ICSD | 166580 | Pmm2 (25) | ✗ | 8 | 64 | 3 | 0.0 | 0.005 | 0.387 | (0;000) | ✔ | 11/04/17 |
KOsNOF5 | ICSD | 166586 | P2_1/m (11) | ✔ | 18 | 142 | 1 | 0.0 | 0.000 | 0.965 | (0;000) | ✗ | 02/02/17 |
CsOsNOF5 | ICSD | 166587 | P2_1/m (11) | ✔ | 18 | 142 | 1 | 0.0 | 0.000 | 0.670 | (0;000) | ✗ | 02/02/17 |
V8O | ICSD | 166600 | P4_2/mnm (136) | ✔ | 18 | 220 | 3 | 0.0 | 0.007 | 0.531 | (1;000) | ✗ | 02/02/17 |
Ca(BH4)2 | ICSD | 166671 | P4_2/m (84) | ✔ | 22 | 48 | 1 | 5.1908 | 5.191 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na3ScCl6 | ICSD | 166749 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 4.0856 | 4.103 | 0.000 | (0;000) | ✗ | 02/02/17 |
TeO2 | ICSD | 166847 | P2_1/m (11) | ✔ | 12 | 72 | 3 | 2.4449 | 2.506 | 0.000 | (0;000) | ✗ | 06/10/16 |
TeO2 | ICSD | 166848 | Ccmm (63) | ✔ | 6 | 36 | 3 | 0.0 | 0.511 | 0.006 | (0;000) | ✗ | 06/10/16 |
CO2 | ICSD | 166852 | R-3c (167) | ✔ | 24 | 128 | 1 | 6.6343 | 6.801 | 0.000 | (0;000) | ✗ | 04/08/17 |
CoSn3 | ICSD | 166871 | Cmce (64) | ✔ | 16 | 236 | 3 | 0.0 | 0.010 | 0.221 | (1;000) | ✗ | 02/02/17 |
Sr2Ti2As2OF2 | ICSD | 167013 | I4/mmm (139) | ✔ | 9 | 74 | 1 | 0.0 | 0.012 | 0.752 | (0;111) | ✗ | 21/03/17 |
Sr2Ti2Sb2OF2 | ICSD | 167014 | I4/mmm (139) | ✔ | 9 | 74 | 1 | 0.0 | 0.022 | 0.576 | (0;000) | ✗ | 22/03/17 |
FePH2O5 | ICSD | 167029 | C2/c (15) | ✔ | 18 | 90 | 3 | 0.0 | 0.000 | 0.307 | (1;100) | ✗ | 27/01/17 |
LiMnVF6 | ICSD | 167073 | P4_2nm (102) | ✗ | 18 | 146 | 3 | 0.0 | 0.000 | 0.631 | ? | ✗ | 22/03/17 |
Bi7O5F11 | ICSD | 167074 | C2 (5) | ✗ | 23 | 212 | 3 | 3.0383 | 3.039 | 0.000 | (0;000) | ✗ | 04/08/17 |