▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NbNiAs | ICSD | 610993 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.009 | 0.242 | (0;000) | ✗ | 05/01/17 |
YZnSn2 | ICSD | 183309 | P4/nmm (129) | ✔ | 8 | 102 | 3 | 0.0 | 0.000 | 0.809 | (0;001) | ✗ | 27/01/17 |
Sn | ICSD | 236751 | Im-3m (229) | ✔ | 1 | 14 | 3 | 0.0 | 0.000 | 0.755 | (1;111) | ✗ | 27/01/17 |
K4CO4 | ICSD | 245418 | R3m (160) | ✗ | 9 | 64 | 3 | 2.2834 | 2.355 | 0.000 | (0;000) | ✗ | 06/10/16 |
PtCl2 | ICSD | 44512 | Pnnm (58) | ✔ | 6 | 48 | 1 | 0.946 | 1.300 | 0.000 | (0;000) | ✗ | 27/01/17 |
K4CO4 | ICSD | 245421 | Cm (8) | ✗ | 9 | 64 | 3 | 0.521 | 0.796 | 0.000 | (0;000) | ✗ | 06/10/16 |
NiAsRh | ICSD | 601484 | P4/nmm (129) | ✔ | 6 | 64 | 3 | 0.0 | 0.000 | 0.305 | (1;001) | ✗ | 05/01/17 |
SrZnSn | ICSD | 54356 | P6_3/mmc (194) | ✔ | 6 | 72 | 2 | 0.0 | 0.013 | 0.185 | (0;000) | ✗ | 27/01/17 |
K4CO4 | ICSD | 245422 | C2 (5) | ✗ | 9 | 64 | 2 | 2.3193 | 2.486 | 0.000 | (0;000) | ✗ | 06/10/16 |
TaNiAs | ICSD | 611079 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.017 | 0.194 | (0;000) | ✗ | 05/01/17 |
ZrSnTe | ICSD | 80190 | P4/nmm (129) | ✔ | 6 | 48 | 3 | 0.0 | 0.016 | 0.042 | (0;001) | ✗ | 27/01/17 |
TiNiAs | ICSD | 611086 | Pnma (62) | ✔ | 12 | 108 | 3 | 0.0 | 0.000 | 0.392 | (1;011) | ✗ | 05/01/17 |
Ti3Sn | ICSD | 106087 | Pm-3m (221) | ✔ | 4 | 50 | 3 | 0.0 | 0.000 | 0.524 | (1;000) | ✗ | 27/01/17 |
Ti3Sn | ICSD | 182427 | P6_3/mmc (194) | ✔ | 8 | 100 | 3 | 0.0 | 0.000 | 0.727 | (1;000) | ✗ | 27/01/17 |
HfC | ICSD | 185992 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.2904 | 0.290 | 0.000 | (0;000) | ✔ | 06/10/16 |
MgSe | ICSD | 658986 | P6_3mc (186) | ✗ | 4 | 32 | 3 | 2.3123 | 2.313 | 0.000 | (0;000) | ✗ | 06/10/16 |
CrCl3 | ICSD | 22081 | R-3 (148) | ✔ | 8 | 70 | 2 | 0.0 | 0.029 | 0.399 | (0;000) | ✗ | 27/01/17 |
K4CO4 | ICSD | 245423 | R3 (146) | ✗ | 9 | 64 | 3 | 3.2247 | 3.274 | 0.000 | (0;000) | ✗ | 06/10/16 |
VNiAs | ICSD | 611097 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.001 | 0.198 | (0;000) | ✗ | 05/01/17 |
V3AsN | ICSD | 610970 | Cmcm (63) | ✔ | 10 | 98 | 3 | 0.0 | 0.000 | 0.863 | (0;110) | ✗ | 05/01/17 |
Sr | ICSD | 109027 | P4/mmm (123) | ✔ | 1 | 10 | 1 | 0.0 | 0.001 | 0.587 | (0;000) | ✗ | 27/01/17 |
Sr | ICSD | 182337 | P6/mmm (191) | ✔ | 1 | 10 | 1 | 0.0 | 0.014 | 0.741 | (0;000) | ✗ | 27/01/17 |
Sr | ICSD | 41236 | P6/mmm (191) | ✔ | 1 | 10 | 1 | 0.0 | 0.018 | 0.306 | (0;000) | ✗ | 27/01/17 |
K4CO4 | ICSD | 245424 | Cm (8) | ✗ | 9 | 64 | 3 | 2.8885 | 2.927 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr | ICSD | 79592 | P6/mmm (191) | ✔ | 1 | 10 | 1 | 0.0 | 0.022 | 0.520 | (0;000) | ✗ | 27/01/17 |
ScAsO4 | ICSD | 155920 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 4.1602 | 4.160 | 0.000 | (0;000) | ✗ | 05/01/17 |
FeCl3 | ICSD | 151400 | R-3 (148) | ✔ | 8 | 58 | 2 | 0.0 | 0.026 | 0.296 | (0;000) | ✗ | 06/10/16 |
K4CO4 | ICSD | 245425 | I-4 (82) | ✗ | 9 | 64 | 3 | 3.5033 | 3.565 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrTe | ICSD | 52491 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 0.0 | 0.039 | 0.061 | (1;000) | ✗ | 27/01/17 |
K4CO4 | ICSD | 245426 | Cm (8) | ✗ | 9 | 64 | 3 | 2.9078 | 3.076 | 0.000 | (0;000) | ✗ | 06/10/16 |
TlAsPd5 | ICSD | 23540 | P4/mmm (123) | ✔ | 7 | 108 | 3 | 0.0 | 0.018 | 0.457 | (1;000) | ✗ | 05/01/17 |
MgTe | ICSD | 159402 | F-43m (216) | ✗ | 2 | 16 | 3 | 2.0409 | 2.041 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrZn5 | ICSD | 418615 | P6/mmm (191) | ✔ | 6 | 70 | 3 | 0.0 | 0.000 | 0.653 | (1;000) | ✗ | 27/01/17 |
GaCl3 | ICSD | 30336 | P-1 (2) | ✔ | 8 | 68 | 1 | 0.0 | 0.013 | 0.056 | (1;000) | ✗ | 06/10/16 |
SnS | ICSD | 52106 | Cmcm (63) | ✔ | 4 | 40 | 1 | 0.0 | 0.084 | 0.171 | (0;000) | ✗ | 27/01/17 |
K4CO4 | ICSD | 245427 | R3 (146) | ✗ | 9 | 64 | 3 | 1.8687 | 2.055 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrAsPd | ICSD | 404723 | P6_3/mmc (194) | ✔ | 6 | 66 | 2 | 0.0 | 0.000 | 0.896 | (0;000) | ✗ | 05/01/17 |
SrS | ICSD | 52111 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 1.0911 | 1.447 | 0.000 | (0;000) | ✗ | 27/01/17 |
TlAsPt5 | ICSD | 611241 | P4/mmm (123) | ✔ | 7 | 68 | 3 | 0.0 | 0.003 | 0.499 | (1;000) | ✗ | 05/01/17 |
Li4CO4 | ICSD | 245388 | P-43m (215) | ✗ | 9 | 40 | 1 | 4.7041 | 5.033 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrAsPt | ICSD | 59187 | P6_3/mmc (194) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 0.783 | (0;000) | ✗ | 05/01/17 |
TlS | ICSD | 651241 | R-3m (166) | ✔ | 4 | 38 | 3 | 0.0 | 0.240 | 0.173 | (0;000) | ✗ | 27/01/17 |
AsRh2 | ICSD | 603878 | Pnma (62) | ✔ | 12 | 156 | 3 | 0.0 | 0.001 | 0.452 | (0;011) | ✗ | 05/01/17 |
LaCl3 | ICSD | 23146 | P2_1/m (11) | ✔ | 8 | 48 | 3 | 4.3718 | 4.372 | 0.000 | (0;000) | ✗ | 06/10/16 |
Li4CO4 | ICSD | 245389 | R3m (160) | ✗ | 9 | 40 | 1 | 1.9001 | 1.995 | 0.000 | (0;000) | ✗ | 06/10/16 |
AsRh | ICSD | 611269 | Pnma (62) | ✔ | 8 | 88 | 3 | 0.0 | 0.008 | 0.375 | (0;000) | ✗ | 05/01/17 |
TaZn2 | ICSD | 652937 | P6_3/mmc (194) | ✔ | 12 | 148 | 3 | 0.0 | 0.024 | 0.315 | (1;000) | ✗ | 27/01/17 |
Tc | ICSD | 76953 | P6_3/mmc (194) | ✔ | 2 | 30 | 3 | 0.0 | 0.000 | 0.631 | (1;000) | ✗ | 27/01/17 |
Li4CO4 | ICSD | 245392 | Cm (8) | ✗ | 9 | 40 | 2 | 4.4214 | 4.983 | 0.000 | (0;000) | ✗ | 06/10/16 |
VAsRh | ICSD | 601550 | Pnma (62) | ✔ | 12 | 140 | 3 | 0.0 | 0.000 | 0.351 | (1;011) | ✗ | 05/01/17 |
YTlTe2 | ICSD | 653098 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.5801 | 1.161 | 0.000 | (0;000) | ✗ | 27/01/17 |
YTe2 | ICSD | 653179 | P4/nmm (129) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.663 | (0;000) | ✗ | 27/01/17 |
ZrTe2 | ICSD | 653213 | P-3m1 (164) | ✔ | 3 | 16 | 2 | 0.0 | 0.002 | 0.303 | (1;001) | ✗ | 27/01/17 |
Ti3Te4 | ICSD | 653076 | C2/m (12) | ✔ | 7 | 60 | 3 | 0.0 | 0.021 | 0.318 | (0;110) | ✗ | 27/01/17 |
AsRu | ICSD | 611293 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.175 | (0;011) | ✗ | 05/01/17 |
SrAs3 | ICSD | 41831 | C2/m (12) | ✔ | 8 | 50 | 1 | 0.0 | 0.043 | 0.272 | (1;001) | ✔ | 05/01/17 |
Ti(VTe2)2 | ICSD | 653087 | C2/m (12) | ✔ | 7 | 62 | 3 | 0.0 | 0.009 | 0.663 | (1;000) | ✗ | 27/01/17 |
ZrTiTe4 | ICSD | 40496 | P2/m (10) | ✔ | 6 | 40 | 2 | 0.0 | 0.018 | 0.262 | (1;010) | ✗ | 27/01/17 |
Te | ICSD | 52500 | R-3m (166) | ✔ | 1 | 6 | 3 | 0.0 | 0.003 | 0.762 | (0;000) | ✗ | 27/01/17 |
CaSb2 | ICSD | 862 | P2_1/m (11) | ✔ | 6 | 40 | 1 | 0.0 | 0.070 | 0.251 | (1;011) | ✔ | 27/01/17 |
Te | ICSD | 97742 | C2/m (12) | ✔ | 3 | 18 | 3 | 0.0 | 0.040 | 0.497 | (1;000) | ✗ | 27/01/17 |
P2W | ICSD | 37223 | Ccm2_1 (36) | ✗ | 6 | 48 | 3 | 0.0 | 0.442 | 0.255 | (1;000) | ✔ | 04/10/16 |
InAs | ICSD | 165462 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.009 | (1;000) | ✔ | 06/10/16 |
ZnTe | ICSD | 184493 | Cmcm (63) | ✔ | 4 | 36 | 3 | 0.0 | 0.064 | 0.275 | (0;000) | ✗ | 27/01/17 |
CI4 | ICSD | 30789 | I-42m (121) | ✗ | 5 | 32 | 1 | 0.9413 | 0.943 | 0.000 | (0;000) | ✗ | 06/10/16 |
Zr3Te | ICSD | 653216 | R-3m (166) | ✔ | 12 | 54 | 3 | 0.0 | 0.047 | 0.356 | (0;111) | ✗ | 27/01/17 |
MgTe | ICSD | 168348 | P6_3mc (186) | ✗ | 4 | 32 | 3 | 2.059 | 2.059 | 0.000 | (0;000) | ✗ | 06/10/16 |
ScCl3 | ICSD | 38235 | R-3 (148) | ✔ | 8 | 64 | 2 | 3.1158 | 3.286 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ti2Zn | ICSD | 653304 | I4/mmm (139) | ✔ | 3 | 36 | 3 | 0.0 | 0.003 | 0.482 | (0;111) | ✗ | 27/01/17 |
Li4CO4 | ICSD | 245393 | C2 (5) | ✗ | 9 | 40 | 2 | 4.5571 | 4.885 | 0.000 | (0;000) | ✗ | 06/10/16 |
Li4CO4 | ICSD | 245405 | C2 (5) | ✗ | 9 | 40 | 1 | 6.7435 | 6.759 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr2As | ICSD | 44066 | I4/mmm (139) | ✔ | 6 | 50 | 1 | 0.0 | 0.019 | 0.112 | (0;111) | ✗ | 05/01/17 |
TiCl3 | ICSD | 38236 | R-3 (148) | ✔ | 8 | 66 | 2 | 0.0 | 0.009 | 0.695 | (0;000) | ✗ | 06/10/16 |
MgCO3 | ICSD | 161821 | C222_1 (20) | ✗ | 10 | 64 | 3 | 6.3279 | 7.357 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ti3As | ICSD | 611501 | Pm-3n (223) | ✔ | 8 | 82 | 3 | 0.0 | 0.000 | 0.927 | (1;000) | ✗ | 05/01/17 |
MgCO3 | ICSD | 180346 | R-3c (167) | ✔ | 10 | 64 | 3 | 5.0198 | 5.730 | 0.000 | (0;000) | ✗ | 06/10/16 |
TiAs | ICSD | 44074 | P6_3/mmc (194) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.681 | (1;000) | ✗ | 05/01/17 |
MnN | ICSD | 184928 | P6_3mc (186) | ✗ | 4 | 40 | 3 | 0.0 | 0.027 | 0.121 | (0;000) | ✔ | 06/10/16 |
OsCl4 | ICSD | 1165 | Cmmm (65) | ✔ | 5 | 44 | 1 | 0.0 | 0.322 | 0.353 | (0;000) | ✗ | 06/10/16 |
MgCO3 | ICSD | 180347 | R-3c (167) | ✔ | 10 | 64 | 3 | 5.1369 | 5.732 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZrW2 | ICSD | 653438 | Fd-3m (227) | ✔ | 6 | 64 | 3 | 0.0 | 0.000 | 0.646 | (0;000) | ✗ | 27/01/17 |
V3As | ICSD | 44084 | Pm-3n (223) | ✔ | 8 | 88 | 3 | 0.0 | 0.000 | 0.281 | (1;000) | ✗ | 05/01/17 |
Y | ICSD | 187638 | C2/m (12) | ✔ | 2 | 22 | 3 | 0.0 | 0.054 | 0.460 | (1;110) | ✗ | 27/01/17 |
Na4CO4 | ICSD | 245406 | P-43m (215) | ✗ | 9 | 64 | 1 | 2.7579 | 3.161 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZrZn2 | ICSD | 653508 | Fd-3m (227) | ✔ | 6 | 56 | 3 | 0.0 | 0.000 | 0.890 | (0;000) | ✗ | 27/01/17 |
VAs | ICSD | 611554 | Pnma (62) | ✔ | 8 | 72 | 3 | 0.0 | 0.003 | 0.186 | (0;000) | ✗ | 05/01/17 |
Zr2Zn | ICSD | 653511 | I4/mmm (139) | ✔ | 3 | 20 | 3 | 0.0 | 0.032 | 0.475 | (0;111) | ✗ | 27/01/17 |
Te | ICSD | 52499 | R-3m (166) | ✔ | 2 | 12 | 3 | 0.0 | 0.136 | 0.557 | (1;000) | ✗ | 27/01/17 |
ZrZn | ICSD | 106235 | Pm-3m (221) | ✔ | 2 | 16 | 3 | 0.0 | 0.022 | 0.090 | (0;111) | ✗ | 27/01/17 |
TlCl2 | ICSD | 4031 | I4_1/a (88) | ✔ | 12 | 108 | 1 | 2.4354 | 2.536 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na4CO4 | ICSD | 245407 | R3m (160) | ✗ | 9 | 64 | 2 | 1.9626 | 2.362 | 0.000 | (0;000) | ✗ | 06/10/16 |
Na4CO4 | ICSD | 245411 | C2 (5) | ✗ | 9 | 64 | 2 | 2.5966 | 2.872 | 0.000 | (0;000) | ✗ | 06/10/16 |
VAg2AsO6 | ICSD | 425757 | P-1 (2) | ✔ | 20 | 152 | 3 | 1.624 | 1.635 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ba3Ag2 | ICSD | 108847 | R-3 (148) | ✔ | 15 | 156 | 2 | 0.0 | 0.002 | 0.564 | (0;111) | ✗ | 30/01/17 |
BeAu2 | ICSD | 150581 | I4/mmm (139) | ✔ | 3 | 26 | 3 | 0.0 | 0.002 | 0.577 | (1;000) | ✗ | 05/01/17 |
MoC | ICSD | 183166 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.417 | (0;000) | ✔ | 06/10/16 |
Zr2ZnAg2F14 | ICSD | 422839 | C2/m (12) | ✔ | 19 | 140 | 3 | 0.2533 | 0.686 | 0.000 | (0;000) | ✗ | 30/01/17 |
MoO3 | ICSD | 80577 | P2_1/m (11) | ✔ | 8 | 64 | 2 | 2.3284 | 3.028 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2Ag2GeS4 | ICSD | 170843 | Fddd (70) | ✔ | 18 | 136 | 3 | 1.788 | 1.788 | 0.000 | (0;000) | ✗ | 30/01/17 |
K2Ag2GeSe4 | ICSD | 420014 | Fddd (70) | ✔ | 18 | 136 | 3 | 1.2339 | 1.270 | 0.000 | (0;000) | ✗ | 30/01/17 |