▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ta3SBr7 | ICSD | 51101 | Cm (8) | ✗ | 11 | 94 | 2 | 0.7877 | 0.789 | 0.000 | (0;000) | ✗ | 06/10/16 |
C | COD | 9012233 | Pcca (54) | ✔ | 16 | 64 | 2 | 0.0 | 0.002 | 0.513 | (1;001) | ✗ | 27/01/17 |
NbGeAs | ICSD | 610611 | P4/nmm (129) | ✔ | 6 | 44 | 2 | 0.0 | 0.022 | 0.299 | (0;001) | ✗ | 05/01/17 |
Bi2CO5 | ICSD | 94740 | Imm2 (44) | ✗ | 8 | 44 | 2 | 0.0 | 0.002 | 0.256 | (0;111) | ✔ | 06/10/16 |
KHgAs | COD | 7221177 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0686 | 0.093 | 0.000 | (0;000) | ✗ | 05/01/17 |
C | COD | 9012231 | Cmme (67) | ✔ | 8 | 32 | 2 | 0.0 | 0.009 | 0.643 | (0;001) | ✗ | 27/01/17 |
CaCO3 | ICSD | 180348 | R-3c (167) | ✔ | 10 | 64 | 2 | 5.0647 | 5.184 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaCO3 | ICSD | 180349 | R-3c (167) | ✔ | 10 | 64 | 2 | 5.1604 | 5.214 | 0.000 | (0;000) | ✗ | 06/10/16 |
Tl2CO3 | COD | 2017545 | C2/m (12) | ✔ | 12 | 96 | 2 | 1.4491 | 2.153 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 1512497 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.043 | (0;000) | ✗ | 27/01/17 |
KZnAs | COD | 7221178 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.2879 | 0.288 | 0.000 | (0;000) | ✗ | 05/01/17 |
LiMnAs | ICSD | 26459 | P4/nmm (129) | ✔ | 6 | 46 | 2 | 0.0 | 0.000 | 0.824 | (0;001) | ✗ | 05/01/17 |
MgCl2 | ICSD | 51244 | Pmmb (51) | ✔ | 6 | 48 | 2 | 0.0 | 0.007 | 0.196 | (0;000) | ✗ | 06/10/16 |
C | COD | 9012237 | Pban (50) | ✔ | 16 | 64 | 2 | 0.0 | 0.001 | 0.117 | (1;000) | ✗ | 27/01/17 |
K4CO4 | ICSD | 245422 | C2 (5) | ✗ | 9 | 64 | 2 | 2.3193 | 2.486 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeCl3 | ICSD | 151400 | R-3 (148) | ✔ | 8 | 58 | 2 | 0.0 | 0.026 | 0.296 | (0;000) | ✗ | 06/10/16 |
SbAsO4 | COD | 9011214 | P2_1/m (11) | ✔ | 12 | 68 | 2 | 0.0 | 3.878 | 1.000 | (0;000) | ✗ | 05/01/17 |
SrGe(PO4)2 | ICSD | 423042 | C2/m (12) | ✔ | 12 | 72 | 2 | 4.4632 | 4.536 | 0.000 | (0;000) | ✗ | 27/01/17 |
As | COD | 9008573 | Cmce (64) | ✔ | 4 | 20 | 2 | 0.0 | 0.219 | 0.019 | (0;000) | ✗ | 05/01/17 |
As | COD | 9008574 | R-3m (166) | ✔ | 2 | 10 | 2 | 0.0 | 0.074 | 0.060 | (1;111) | ✗ | 05/01/17 |
CrCl3 | ICSD | 22081 | R-3 (148) | ✔ | 8 | 70 | 2 | 0.0 | 0.029 | 0.399 | (0;000) | ✗ | 27/01/17 |
SrAsPd | ICSD | 404723 | P6_3/mmc (194) | ✔ | 6 | 66 | 2 | 0.0 | 0.000 | 0.896 | (0;000) | ✗ | 05/01/17 |
SrAsPt | ICSD | 59187 | P6_3/mmc (194) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 0.783 | (0;000) | ✗ | 05/01/17 |
Li4CO4 | ICSD | 245392 | Cm (8) | ✗ | 9 | 40 | 2 | 4.4214 | 4.983 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiCoF4 | COD | 1000261 | P2_1/c (14) | ✔ | 12 | 96 | 2 | 0.0757 | 0.121 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiCl3 | ICSD | 38236 | R-3 (148) | ✔ | 8 | 66 | 2 | 0.0 | 0.009 | 0.695 | (0;000) | ✗ | 06/10/16 |
Li4CO4 | ICSD | 245393 | C2 (5) | ✗ | 9 | 40 | 2 | 4.5571 | 4.885 | 0.000 | (0;000) | ✗ | 06/10/16 |
MoO3 | ICSD | 80577 | P2_1/m (11) | ✔ | 8 | 64 | 2 | 2.3284 | 3.028 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScCl3 | ICSD | 38235 | R-3 (148) | ✔ | 8 | 64 | 2 | 3.1158 | 3.286 | 0.000 | (0;000) | ✗ | 06/10/16 |
Na4CO4 | ICSD | 245407 | R3m (160) | ✗ | 9 | 64 | 2 | 1.9626 | 2.362 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaAu2 | COD | 1510358 | P6/mmm (191) | ✔ | 3 | 32 | 2 | 0.0 | 0.089 | 0.386 | (1;000) | ✗ | 05/01/17 |
Na4CO4 | ICSD | 245411 | C2 (5) | ✗ | 9 | 64 | 2 | 2.5966 | 2.872 | 0.000 | (0;000) | ✗ | 06/10/16 |
MoS2 | ICSD | 38401 | R3m (160) | ✗ | 3 | 26 | 2 | 0.8476 | 1.670 | 0.000 | (0;000) | ✗ | 06/10/16 |
Na4CO4 | ICSD | 245414 | Cm (8) | ✗ | 9 | 64 | 2 | 3.6393 | 3.918 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeSe | COD | 1528768 | Pnma (62) | ✔ | 8 | 40 | 2 | 0.5998 | 0.700 | 0.000 | (0;000) | ✗ | 27/01/17 |
CN2 | ICSD | 247676 | P-42_1m (113) | ✗ | 6 | 28 | 2 | 4.6848 | 4.993 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsAu3S2 | COD | 1510489 | P-3m1 (164) | ✔ | 6 | 54 | 2 | 1.6491 | 1.649 | 0.000 | (0;000) | ✗ | 05/01/17 |
GeS | COD | 9008784 | Pnma (62) | ✔ | 8 | 40 | 2 | 0.9053 | 1.017 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsAu3Se2 | COD | 1510490 | P-3m1 (164) | ✔ | 6 | 54 | 2 | 1.5634 | 1.592 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaPd | ICSD | 616028 | Cmcm (63) | ✔ | 4 | 56 | 2 | 0.0 | 0.065 | 0.082 | (1;011) | ✗ | 05/01/17 |
RbAu3Se2 | COD | 1510509 | P-3m1 (164) | ✔ | 6 | 54 | 2 | 1.108 | 1.572 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaBiAu | COD | 1510590 | P6_3/mmc (194) | ✔ | 6 | 72 | 2 | 0.0 | 0.026 | 0.361 | (1;000) | ✗ | 05/01/17 |
BaSbAu | COD | 1510593 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.001 | 0.453 | (1;000) | ✗ | 05/01/17 |
BaSbAu | COD | 2200818 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.013 | 0.051 | (1;000) | ✗ | 05/01/17 |
CaPAu | COD | 1510061 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.002 | 0.059 | (1;000) | ✗ | 05/01/17 |
CaSbAu | COD | 1510062 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.040 | 0.110 | (1;000) | ✗ | 05/01/17 |
KTeAu | COD | 1510208 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.002 | 0.029 | (1;000) | ✗ | 05/01/17 |
Mg3Au | COD | 1510237 | P6_3/mmc (194) | ✔ | 8 | 82 | 2 | 0.0 | 0.000 | 0.835 | (0;000) | ✗ | 05/01/17 |
NaTeAu | COD | 1510246 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.001 | 0.028 | (1;000) | ✗ | 05/01/17 |
RbAuO2 | COD | 1510261 | Cmcm (63) | ✔ | 8 | 64 | 2 | 1.3974 | 1.777 | 0.000 | (0;000) | ✗ | 05/01/17 |