▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Zr2NiAs2 | ICSD | 68141 | P6_3/mmc (194) | ✔ | 10 | 56 | 3 | 0.0 | 0.002 | 0.296 | (0;000) | ✗ | 05/01/17 |
As2PbO6 | ICSD | 81063 | P-31m (162) | ✔ | 9 | 60 | 3 | 2.6716 | 2.672 | 0.000 | (0;000) | ✗ | 05/01/17 |
Sr2SnO4 | ICSD | 150388 | I4/mmm (139) | ✔ | 7 | 58 | 2 | 2.8857 | 3.258 | 0.000 | (0;000) | ✗ | 27/01/17 |
KO2 | ICSD | 38230 | C2/c (15) | ✔ | 6 | 42 | 2 | 0.0 | 0.000 | 0.626 | (1;011) | ✔ | 27/01/17 |
YTaO4 | ICSD | 109190 | C2/c (15) | ✔ | 12 | 96 | 3 | 4.321 | 4.479 | 0.000 | (0;000) | ✗ | 27/01/17 |
SnO2 | ICSD | 56677 | Pa3 (205) | ✔ | 12 | 104 | 3 | 2.2532 | 2.319 | 0.000 | (0;000) | ✗ | 27/01/17 |
BC5 | ICSD | 166556 | P-1 (2) | ✔ | 12 | 46 | 3 | 0.0 | 0.084 | 0.417 | (1;110) | ✗ | 06/10/16 |
FeBiO3 | ICSD | 260118 | R3c (161) | ✗ | 10 | 62 | 3 | 0.0 | 0.001 | 0.605 | ? | ✗ | 06/10/16 |
YVO4 | ICSD | 174550 | I4_1/a (88) | ✔ | 12 | 96 | 3 | 3.5058 | 3.536 | 0.000 | (0;000) | ✗ | 27/01/17 |
As2PdO6 | ICSD | 187099 | P-31m (162) | ✔ | 9 | 64 | 3 | 0.0 | 0.000 | 0.618 | (0;000) | ✗ | 05/01/17 |
Sr(AsO3)2 | ICSD | 420296 | P-31m (162) | ✔ | 9 | 56 | 2 | 3.8678 | 4.175 | 0.000 | (0;000) | ✗ | 05/01/17 |
TaPO5 | ICSD | 87281 | P4/n (85) | ✔ | 14 | 96 | 3 | 4.0586 | 4.475 | 0.000 | (0;000) | ✗ | 27/01/17 |
V2PO5 | ICSD | 79681 | I4_1/amd (141) | ✔ | 16 | 122 | 3 | 0.0 | 0.000 | 0.725 | (1;111) | ✗ | 27/01/17 |
VPO5 | ICSD | 108983 | P4/n (85) | ✔ | 14 | 96 | 3 | 1.0535 | 1.201 | 0.000 | (0;000) | ✗ | 27/01/17 |
VPO5 | ICSD | 425536 | P4/n (85) | ✔ | 14 | 96 | 3 | 2.1052 | 2.158 | 0.000 | (0;000) | ✗ | 27/01/17 |
VPO5 | ICSD | 425552 | C2/m (12) | ✔ | 14 | 96 | 2 | 1.1715 | 1.369 | 0.000 | (0;000) | ✗ | 27/01/17 |
VPO5 | ICSD | 77598 | P4/n (85) | ✔ | 14 | 96 | 2 | 0.4974 | 0.497 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeBiO3 | ICSD | 260119 | R3c (161) | ✗ | 10 | 62 | 3 | 0.0 | 0.001 | 0.531 | ? | ✗ | 06/10/16 |
Sr4As2O | ICSD | 33904 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 1.1057 | 1.131 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ta2O5 | ICSD | 95462 | Pmmm (47) | ✔ | 7 | 56 | 3 | 0.0961 | 0.371 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaGa | ICSD | 260641 | Ccmm (63) | ✔ | 4 | 46 | 1 | 0.0 | 0.000 | 0.830 | (0;000) | ✗ | 06/10/16 |
Ti4O5 | ICSD | 77697 | I4/m (87) | ✔ | 9 | 78 | 3 | 0.0 | 0.006 | 0.832 | (1;111) | ✗ | 27/01/17 |
V2O5 | ICSD | 156052 | C2/c (15) | ✔ | 14 | 112 | 3 | 1.3792 | 1.492 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeBiO3 | ICSD | 51664 | R3c (161) | ✗ | 10 | 62 | 3 | 0.0 | 0.000 | 0.523 | ? | ✗ | 06/10/16 |
V2O5 | ICSD | 43132 | Pmmn (59) | ✔ | 14 | 112 | 1 | 0.0 | 0.004 | 0.487 | (0;000) | ✗ | 27/01/17 |
Sr(AsPd)2 | ICSD | 36374 | I4/mmm (139) | ✔ | 5 | 56 | 3 | 0.0 | 0.009 | 0.729 | (0;111) | ✗ | 05/01/17 |
Sr(AsRu)2 | ICSD | 611298 | I4/mmm (139) | ✔ | 5 | 52 | 2 | 0.0 | 0.007 | 0.548 | (1;000) | ✗ | 05/01/17 |
ScTa(PbO3)2 | ICSD | 77739 | Fm-3m (225) | ✔ | 10 | 88 | 3 | 2.2483 | 2.248 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeBiO3 | ICSD | 75324 | R3c (161) | ✗ | 10 | 62 | 3 | 0.0 | 0.001 | 0.525 | ? | ✗ | 06/10/16 |
Zn(PtO2)3 | ICSD | 35339 | Cmmm (65) | ✔ | 10 | 78 | 3 | 0.1944 | 0.194 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2YReO6 | ICSD | 25404 | Fm-3m (225) | ✔ | 10 | 82 | 3 | 0.0 | 0.000 | 0.584 | (0;000) | ✗ | 27/01/17 |
Sr(RuO3)2 | ICSD | 248351 | P-31m (162) | ✔ | 9 | 78 | 2 | 0.0589 | 0.098 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaGe2 | ICSD | 185655 | P6_3mc (186) | ✗ | 6 | 36 | 1 | 0.0 | 0.071 | 0.116 | (1;000) | ✔ | 04/10/16 |
Sr2YSbO6 | ICSD | 157886 | Fm-3m (225) | ✔ | 10 | 72 | 3 | 3.803 | 3.803 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2YTaO6 | ICSD | 247458 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 3.5326 | 3.533 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2ZrTiO6 | ICSD | 190548 | I4/m (87) | ✔ | 10 | 72 | 3 | 2.6501 | 2.673 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2ZnWO6 | ICSD | 28599 | Fm-3m (225) | ✔ | 10 | 82 | 3 | 0.0 | 0.128 | 0.064 | (0;000) | ✗ | 27/01/17 |
NbSb2 | ICSD | 18144 | C2/m (12) | ✔ | 6 | 46 | 3 | 0.0 | 0.029 | 0.087 | (0;100) | ✔ | 04/10/16 |
GaAs | ICSD | 190423 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.685 | 0.685 | 0.000 | (0;000) | ✗ | 06/10/16 |
V2ZnO6 | ICSD | 30880 | C2/m (12) | ✔ | 9 | 74 | 3 | 2.3293 | 2.384 | 0.000 | (0;000) | ✗ | 27/01/17 |
SiP2O7 | ICSD | 423437 | P2_1/c (14) | ✔ | 20 | 112 | 3 | 5.4719 | 5.472 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn2P2O7 | ICSD | 24153 | C2/m (12) | ✔ | 11 | 76 | 3 | 3.6804 | 4.229 | 0.000 | (0;000) | ✗ | 27/01/17 |
RuBr3 | ICSD | 28119 | Cm2m (38) | ✗ | 8 | 74 | 1 | 0.0 | 0.064 | 0.330 | (0;000) | ✔ | 06/10/16 |
KSb2 | ICSD | 80945 | C2/m (12) | ✔ | 6 | 38 | 1 | 0.1801 | 0.569 | 0.000 | (0;000) | ✔ | 02/02/17 |
V2Zn2O7 | ICSD | 250002 | C2/m (12) | ✔ | 11 | 92 | 3 | 2.8851 | 3.204 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaGe | ICSD | 185653 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.031 | 0.197 | (0;110) | ✗ | 06/10/16 |
RbTa(PO4)2 | ICSD | 54098 | C2/m (12) | ✔ | 12 | 80 | 2 | 3.5625 | 3.682 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeBiO3 | ICSD | 97591 | R3c (161) | ✗ | 10 | 62 | 3 | 0.0 | 0.000 | 0.523 | ? | ✗ | 06/10/16 |
V2Pb3O8 | ICSD | 69798 | R-3m (166) | ✔ | 13 | 116 | 3 | 2.6673 | 2.802 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(ReO4)2 | ICSD | 51017 | P-3 (147) | ✔ | 11 | 90 | 3 | 4.3345 | 4.374 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr3V2O8 | ICSD | 167701 | R-3m (166) | ✔ | 13 | 104 | 1 | 4.1826 | 4.367 | 0.000 | (0;000) | ✗ | 27/01/17 |
O2 | ICSD | 164724 | P6_3/mmc (194) | ✔ | 4 | 24 | 1 | 0.0 | 0.002 | 0.588 | (1;000) | ✗ | 27/01/17 |
O2 | ICSD | 236857 | C2/m (12) | ✔ | 8 | 48 | 1 | 0.0 | 0.401 | 0.146 | (0;000) | ✗ | 27/01/17 |
O2 | ICSD | 28530 | P4/mmm (123) | ✔ | 1 | 6 | 1 | 0.0 | 0.025 | 0.322 | (0;000) | ✗ | 27/01/17 |
Sr(ZnAs)2 | ICSD | 23248 | P-3m1 (164) | ✔ | 5 | 44 | 2 | 0.2109 | 0.211 | 0.000 | (0;000) | ✗ | 05/01/17 |
O2 | ICSD | 190369 | R-3m (166) | ✔ | 2 | 12 | 1 | 0.0 | 0.027 | 0.525 | (0;000) | ✗ | 27/01/17 |
Sr4P2O | ICSD | 33903 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 1.2028 | 1.238 | 0.000 | (0;000) | ✗ | 27/01/17 |
Te3As2 | ICSD | 68110 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.0 | 0.077 | 0.045 | (1;000) | ✗ | 05/01/17 |
BiTeI | ICSD | 10500 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.255 | (0;000) | ✔ | 06/10/16 |
CaP3 | ICSD | 74479 | P-1 (2) | ✔ | 8 | 50 | 1 | 0.0 | 0.016 | 0.024 | (1;010) | ✗ | 27/01/17 |
BiTeI | ICSD | 263109 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.1819 | 0.182 | 0.000 | (0;000) | ✔ | 06/10/16 |
LiN3 | ICSD | 34675 | C2/m (12) | ✔ | 4 | 18 | 1 | 3.7952 | 4.288 | 0.000 | (0;000) | ✗ | 27/01/17 |
Pd2O | ICSD | 77651 | Pn-3m (224) | ✔ | 6 | 84 | 3 | 0.0 | 0.000 | 0.351 | (0;111) | ✗ | 27/01/17 |
PdO | ICSD | 41617 | I4/mmm (139) | ✔ | 2 | 24 | 3 | 0.0 | 0.011 | 0.625 | (0;000) | ✗ | 27/01/17 |
BiTeI | ICSD | 74501 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.003 | 0.261 | (0;000) | ✔ | 06/10/16 |
PdO | ICSD | 77650 | Fm-3m (225) | ✔ | 2 | 24 | 1 | 0.0 | 0.000 | 0.599 | (0;000) | ✗ | 27/01/17 |
Mo2As3 | ICSD | 43184 | C2/m (12) | ✔ | 10 | 86 | 3 | 0.0 | 0.017 | 0.254 | (0;111) | ✗ | 05/01/17 |
PtO | ICSD | 164290 | P4_2/mmc (131) | ✔ | 4 | 32 | 3 | 0.0 | 0.001 | 0.128 | (0;000) | ✗ | 27/01/17 |
K2Se3 | ICSD | 1264 | Ccm2_1 (36) | ✗ | 10 | 72 | 1 | 0.7025 | 0.851 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaSi | ICSD | 190659 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.007 | 0.172 | (1;000) | ✗ | 06/10/16 |
BiTeI | ICSD | 79364 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.006 | (1;100) | ✔ | 06/10/16 |
Sr(POs)2 | ICSD | 602096 | I4/mmm (139) | ✔ | 5 | 52 | 2 | 0.0 | 0.004 | 0.626 | (1;111) | ✗ | 27/01/17 |
ScOs2 | ICSD | 647766 | P6_3/mmc (194) | ✔ | 12 | 172 | 3 | 0.0 | 0.004 | 0.938 | (1;000) | ✗ | 27/01/17 |
ZrOs2 | ICSD | 647879 | P6_3/mmc (194) | ✔ | 12 | 144 | 3 | 0.0 | 0.006 | 0.477 | (1;000) | ✗ | 27/01/17 |
ZrSiO | ICSD | 25731 | P4/nmm (129) | ✔ | 6 | 28 | 2 | 0.0 | 0.041 | 0.027 | (0;001) | ✗ | 27/01/17 |
Mo5As4 | ICSD | 43187 | I4/m (87) | ✔ | 9 | 90 | 3 | 0.0 | 0.001 | 0.537 | (1;000) | ✗ | 05/01/17 |
Mo5As4 | ICSD | 610956 | I4/m (87) | ✔ | 9 | 90 | 3 | 0.0 | 0.001 | 0.847 | (1;111) | ✗ | 05/01/17 |
InBiS3 | ICSD | 290195 | P2_1 (4) | ✗ | 10 | 72 | 3 | 0.8716 | 1.031 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaAsAu | ICSD | 420341 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.000 | 0.046 | (1;000) | ✗ | 05/01/17 |
CaAsAu | ICSD | 107915 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.020 | 0.040 | (1;000) | ✗ | 05/01/17 |
POsSe | ICSD | 647716 | P2_1/c (14) | ✔ | 12 | 108 | 3 | 0.762 | 1.054 | 0.000 | (0;000) | ✗ | 27/01/17 |
POsS | ICSD | 647714 | P2_1/c (14) | ✔ | 12 | 108 | 3 | 0.8312 | 1.100 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrPOs | ICSD | 647720 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.001 | 0.549 | (1;011) | ✗ | 27/01/17 |
TiSi2 | ICSD | 168418 | Cmcm (63) | ✔ | 6 | 40 | 3 | 0.0 | 0.009 | 0.350 | (0;110) | ✗ | 27/01/17 |
ScAl3 | ICSD | 107878 | Pm-3m (221) | ✔ | 4 | 20 | 3 | 0.0 | 0.000 | 0.463 | (0;111) | ✗ | 05/01/17 |
Na2AsAu | ICSD | 23254 | Cmcm (63) | ✔ | 8 | 68 | 1 | 0.2318 | 0.248 | 0.000 | (0;000) | ✗ | 05/01/17 |
ZrSiOs | ICSD | 647807 | Pnma (62) | ✔ | 12 | 96 | 3 | 0.0 | 0.055 | 0.317 | (1;000) | ✗ | 27/01/17 |
B6As | ICSD | 107916 | R-3m (166) | ✔ | 14 | 46 | 3 | 2.5791 | 2.612 | 0.000 | (0;000) | ✗ | 05/01/17 |
ZrSO | ICSD | 36111 | P4/nmm (129) | ✔ | 6 | 32 | 3 | 0.8081 | 0.808 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li5BiO5 | ICSD | 203031 | Cm (8) | ✗ | 11 | 50 | 2 | 1.5359 | 1.767 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ti2O | ICSD | 24081 | P-3m1 (164) | ✔ | 3 | 30 | 3 | 0.0 | 0.025 | 0.314 | (0;000) | ✗ | 27/01/17 |
BaCdAsF | ICSD | 189938 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.8914 | 0.891 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ti3O | ICSD | 23575 | P-31m (162) | ✔ | 8 | 84 | 3 | 0.0 | 0.003 | 0.542 | (0;001) | ✗ | 27/01/17 |
Ti6O | ICSD | 20042 | P-31m (162) | ✔ | 7 | 78 | 3 | 0.0 | 0.003 | 0.638 | (1;001) | ✗ | 27/01/17 |
BaCuAs | ICSD | 41705 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.0 | 0.214 | 0.134 | (0;000) | ✗ | 05/01/17 |
Zr2O | ICSD | 77714 | Pn-3m (224) | ✔ | 6 | 28 | 3 | 0.0 | 0.000 | 0.564 | (0;111) | ✗ | 27/01/17 |
Zr3O | ICSD | 27023 | R-3c (167) | ✔ | 8 | 36 | 3 | 0.0 | 0.010 | 0.240 | (1;000) | ✗ | 27/01/17 |
CdC | ICSD | 183178 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.000 | 0.842 | (0;000) | ✔ | 06/10/16 |
Sr(PPd)2 | ICSD | 36373 | I4/mmm (139) | ✔ | 5 | 56 | 2 | 0.0 | 0.055 | 0.807 | (1;000) | ✗ | 27/01/17 |
LaS | ICSD | 69581 | Cm2e (39) | ✗ | 4 | 18 | 2 | 0.0 | 0.001 | 0.772 | (0;010) | ✔ | 06/10/16 |