▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
CsZn4P3 | ICSD | 262031 | P4/mmm (123) | ✔ | 8 | 72 | 2 | 0.0592 | 0.059 | 0.000 | (0;000) | ✗ | 07/04/17 |
RbZn4As3 | ICSD | 262038 | P4/mmm (123) | ✔ | 8 | 72 | 2 | 0.0 | 0.021 | 0.003 | (0;001) | ✗ | 07/04/17 |
RbZn4P3 | ICSD | 262039 | P4/mmm (123) | ✔ | 8 | 72 | 2 | 0.1514 | 0.151 | 0.000 | (0;000) | ✗ | 07/04/17 |
Ba2NF | ICSD | 262049 | R-3m (166) | ✔ | 4 | 32 | 1 | 0.9466 | 0.947 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2NCl | ICSD | 262051 | R-3m (166) | ✔ | 4 | 32 | 1 | 0.9986 | 0.999 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2BrN | ICSD | 262056 | R-3m (166) | ✔ | 4 | 32 | 1 | 0.9748 | 0.975 | 0.000 | (0;000) | ✗ | 05/01/17 |
LiAl | ICSD | 262064 | Cmce (64) | ✔ | 24 | 72 | 2 | 0.0 | 0.004 | 0.581 | (0;000) | ✗ | 04/08/17 |
NaTl | ICSD | 262066 | P6_3/mmc (194) | ✔ | 8 | 88 | 1 | 0.0 | 0.009 | 0.204 | (0;000) | ✗ | 02/02/17 |
LiTl | ICSD | 262068 | Cmce (64) | ✔ | 24 | 192 | 3 | 2.5122 | 0.894 | 1.000 | (0;000) | ✗ | 07/08/17 |
LiAl | ICSD | 262069 | P6_3/mmc (194) | ✔ | 8 | 24 | 1 | 0.0 | 0.000 | 0.353 | (0;000) | ✗ | 05/01/17 |
LiTl | ICSD | 262070 | P6_3/mmc (194) | ✔ | 8 | 64 | 3 | 0.0 | 0.033 | 0.179 | (0;000) | ✗ | 27/01/17 |
KTl | ICSD | 262071 | P6_3/mmc (194) | ✔ | 8 | 88 | 1 | 0.0 | 0.030 | 0.064 | (0;000) | ✗ | 02/02/17 |
K3AlF6 | ICSD | 262078 | Fm-3m (225) | ✔ | 10 | 72 | 3 | 6.4532 | 6.453 | 0.000 | (0;000) | ✗ | 05/01/17 |
Mg(BH4)2 | ICSD | 262083 | P4_2nm (102) | ✗ | 22 | 48 | 3 | 5.5084 | 5.786 | 0.000 | (0;000) | ✗ | 04/08/17 |
Zn(H3C)2 | ICSD | 262113 | P2_1/c (14) | ✔ | 18 | 52 | 2 | 4.5024 | 4.572 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaFeO3 | ICSD | 262131 | Pm-3m (221) | ✔ | 5 | 36 | 3 | 0.0 | 0.000 | 0.821 | (1;000) | ✗ | 05/01/17 |
Sb2Te3 | ICSD | 262172 | C2/m (12) | ✔ | 10 | 56 | 3 | 0.0 | 0.037 | 0.556 | (0;000) | ✗ | 02/02/17 |
KSrCO3F | ICSD | 262231 | P-6m2 (187) | ✗ | 7 | 48 | 1 | 4.1919 | 4.195 | 0.000 | (0;000) | ✗ | 15/02/17 |
RbSrCO3F | ICSD | 262233 | P-6m2 (187) | ✗ | 7 | 48 | 1 | 4.2648 | 4.268 | 0.000 | (0;000) | ✗ | 15/02/17 |
NaMgSO4F | ICSD | 262272 | C2/c (15) | ✔ | 16 | 112 | 3 | 5.6507 | 5.651 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaCuSO4F | ICSD | 262273 | C2/c (15) | ✔ | 16 | 114 | 3 | 0.0 | 0.000 | 0.143 | (1;101) | ✗ | 27/01/17 |
NaZnSO4F | ICSD | 262274 | C2/c (15) | ✔ | 16 | 116 | 3 | 4.4205 | 4.421 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaCoSO4F | ICSD | 262275 | C2/c (15) | ✔ | 16 | 126 | 3 | 0.0 | 0.001 | 0.551 | (1;011) | ✗ | 27/01/17 |
NaFeSO4F | ICSD | 262276 | C2/c (15) | ✔ | 16 | 108 | 3 | 0.1321 | 0.161 | 0.000 | (0;000) | ✗ | 27/01/17 |
MgPb2WO6 | ICSD | 262284 | Fm-3m (225) | ✔ | 10 | 88 | 3 | 2.3897 | 2.412 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca3WO6 | ICSD | 262323 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 3.2315 | 3.447 | 0.000 | (0;000) | ✗ | 02/02/17 |
Mg2NF | ICSD | 262327 | I4_1/amd (141) | ✔ | 8 | 64 | 3 | 2.2789 | 2.355 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr3Fe2(OF)4 | ICSD | 262347 | F222 (22) | ✗ | 13 | 98 | 2 | 0.0 | 0.003 | 0.970 | ? | ✗ | 15/02/17 |
SrF2 | ICSD | 262349 | Pnma (62) | ✔ | 12 | 96 | 2 | 0.0 | 0.001 | 0.071 | (1;000) | ✗ | 27/01/17 |
Sr2CoReO6 | ICSD | 262352 | I4/m (87) | ✔ | 10 | 88 | 3 | 0.0 | 0.007 | 0.544 | (0;000) | ✗ | 27/01/17 |
LiYSi | ICSD | 262362 | P-62m (189) | ✗ | 9 | 54 | 3 | 0.0 | 0.007 | 0.140 | (1;000) | ✔ | 06/10/16 |
YSi | ICSD | 262364 | Cmcm (63) | ✔ | 4 | 30 | 3 | 0.0 | 0.000 | 0.724 | (0;110) | ✗ | 06/10/16 |
ZnCu2SnS4 | ICSD | 262388 | I-4 (82) | ✗ | 8 | 72 | 3 | 0.2908 | 0.291 | 0.000 | (0;000) | ✔ | 15/02/17 |
Rb2SnHgTe4 | ICSD | 262390 | I-42m (121) | ✗ | 8 | 68 | 1 | 0.3755 | 0.886 | 0.000 | (0;000) | ✔ | 29/03/17 |
Na3Ag3W2(OF)6 | ICSD | 262534 | R-3 (148) | ✔ | 20 | 194 | 1 | 2.4158 | 2.564 | 0.000 | (0;000) | ✗ | 11/04/17 |
K3NiO2 | ICSD | 262579 | P4_2/mnm (136) | ✔ | 12 | 98 | 2 | 0.0 | 0.000 | 0.603 | (0;000) | ✗ | 02/02/17 |
K2B(CN)3 | ICSD | 262588 | Fdd2 (43) | ✗ | 18 | 96 | 1 | 2.5094 | 2.511 | 0.000 | (0;000) | ✗ | 21/03/17 |
Cd(BH4)2 | ICSD | 262600 | P4_2nm (102) | ✗ | 22 | 52 | 3 | 3.7041 | 3.716 | 0.000 | (0;000) | ✗ | 04/08/17 |
CaGe3 | ICSD | 262736 | I4/mmm (139) | ✔ | 16 | 88 | 1 | 0.0 | 0.007 | 0.607 | (0;111) | ✗ | 02/02/17 |
Ba2YGaSe5 | ICSD | 262882 | P-1 (2) | ✔ | 18 | 148 | 3 | 1.4878 | 1.895 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba2YInSe5 | ICSD | 262888 | Cmc2_1 (36) | ✗ | 18 | 148 | 1 | 1.1362 | 1.136 | 0.000 | (0;000) | ✗ | 21/03/17 |
Sr2ScSbO6 | ICSD | 262994 | P2_1/c (14) | ✔ | 20 | 144 | 3 | 3.7678 | 3.771 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca2ScSbO6 | ICSD | 262995 | P2_1/c (14) | ✔ | 20 | 144 | 3 | 3.8324 | 4.021 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaSi3 | ICSD | 263004 | I4/mmm (139) | ✔ | 16 | 88 | 1 | 0.0 | 0.003 | 0.736 | (0;111) | ✗ | 02/02/17 |
YSi3 | ICSD | 263005 | I4/mmm (139) | ✔ | 16 | 92 | 3 | 0.0 | 0.004 | 0.638 | (0;000) | ✗ | 02/02/17 |
Ba2Ti2Fe2As4O | ICSD | 263018 | I4/mmm (139) | ✔ | 11 | 86 | 1 | 0.0 | 0.008 | 0.714 | (0;111) | ✗ | 21/03/17 |
CaNiGeH | ICSD | 263028 | P4/nmm (129) | ✔ | 8 | 50 | 1 | 0.0 | 0.000 | 0.741 | (1;000) | ✗ | 27/01/17 |
Pd2PbO4 | ICSD | 263049 | I4_1/a (88) | ✔ | 14 | 148 | 3 | 0.0 | 0.023 | 0.457 | (1;111) | ✗ | 27/01/17 |
Bi(PdO2)2 | ICSD | 263051 | P-1 (2) | ✔ | 14 | 150 | 3 | 0.0 | 0.134 | 0.105 | (0;000) | ✗ | 05/01/17 |
BiTeI | ICSD | 263109 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.1819 | 0.182 | 0.000 | (0;000) | ✔ | 06/10/16 |
AlPO4 | ICSD | 279582 | P6_3mc (186) | ✗ | 12 | 64 | 3 | 5.6277 | 5.628 | 0.000 | (0;000) | ✗ | 06/10/16 |
TiNb3O6 | ICSD | 280002 | R-3 (148) | ✔ | 20 | 174 | 3 | 0.5492 | 0.739 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb2Te3 | ICSD | 280016 | C2/m (12) | ✔ | 10 | 88 | 3 | 0.0 | 0.017 | 0.376 | (1;000) | ✗ | 02/02/17 |
Cs2Al2P2O9 | ICSD | 280275 | P-1 (2) | ✔ | 15 | 88 | 2 | 5.2554 | 5.386 | 0.000 | (0;000) | ✗ | 30/01/17 |
NaNO2 | ICSD | 280361 | Imm2 (44) | ✗ | 4 | 26 | 1 | 2.4411 | 2.622 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ta2O5 | ICSD | 280397 | C2 (5) | ✗ | 7 | 56 | 3 | 0.4534 | 1.346 | 0.000 | (0;000) | ✔ | 06/10/16 |
B4CCl6O | ICSD | 280617 | R3m (160) | ✗ | 12 | 64 | 1 | 4.1136 | 4.192 | 0.000 | (0;000) | ✗ | 22/03/17 |
ZrTe | ICSD | 280620 | Pmnb (62) | ✔ | 8 | 72 | 3 | 0.0 | 0.014 | 0.144 | (0;000) | ✗ | 06/10/16 |
Ba | ICSD | 280680 | P6/mmm (191) | ✔ | 2 | 20 | 1 | 0.0 | 0.000 | 0.916 | (1;001) | ✗ | 02/02/17 |
BaN2 | ICSD | 280681 | C2/c (15) | ✔ | 6 | 40 | 1 | 0.0 | 0.007 | 0.652 | (0;000) | ✔ | 06/10/16 |
Sc2C | ICSD | 280743 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.0 | 0.001 | 0.283 | (1;001) | ✗ | 27/01/17 |
AlPO4 | ICSD | 280772 | P2_1 (4) | ✗ | 12 | 64 | 3 | 5.6811 | 5.681 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlPO4 | ICSD | 280773 | P2_1 (4) | ✗ | 12 | 64 | 3 | 5.6822 | 5.682 | 0.000 | (0;000) | ✗ | 06/10/16 |
Li2GePbS4 | ICSD | 281011 | I-42m (121) | ✗ | 8 | 48 | 2 | 1.4519 | 1.524 | 0.000 | (0;000) | ✗ | 15/02/17 |
FePO4 | ICSD | 281079 | P2_1/c (14) | ✔ | 24 | 148 | 3 | 0.0 | 0.000 | 0.467 | (0;111) | ✗ | 04/08/17 |
Y | ICSD | 281365 | P2_1/m (11) | ✔ | 2 | 22 | 1 | 0.0 | 0.000 | 0.850 | (1;000) | ✗ | 02/02/17 |
VO2 | ICSD | 281368 | Pnma (62) | ✔ | 24 | 200 | 3 | 0.0 | 0.006 | 0.723 | (0;000) | ✗ | 04/08/17 |
FeN3ClO3 | ICSD | 281495 | P6_3mc (186) | ✗ | 16 | 96 | 1 | 1.311 | 1.369 | 0.000 | (0;000) | ✗ | 22/03/17 |
K2Hg3(GeS4)2 | ICSD | 281506 | C2 (5) | ✗ | 15 | 110 | 3 | 1.5376 | 2.063 | 0.000 | (0;000) | ✗ | 22/03/17 |
CsGaS3 | ICSD | 281723 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 2.6307 | 2.708 | 0.000 | (0;000) | ✗ | 02/02/17 |
MnGeO3 | ICSD | 290044 | C2/c (15) | ✔ | 20 | 148 | 3 | 0.0 | 0.009 | 0.308 | (0;110) | ✗ | 02/02/17 |
Al2CoO4 | ICSD | 290133 | Fd-3m (227) | ✔ | 14 | 94 | 3 | 0.0 | 0.000 | 0.270 | (0;000) | ✗ | 05/01/17 |
HfCuGe | ICSD | 290194 | I4/mmm (139) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.623 | (1;000) | ✗ | 27/01/17 |
InBiS3 | ICSD | 290195 | P2_1 (4) | ✗ | 10 | 72 | 3 | 0.8716 | 1.031 | 0.000 | (0;000) | ✗ | 06/10/16 |
Li2VF6 | ICSD | 290251 | P2_1/c (14) | ✔ | 18 | 122 | 1 | 0.0 | 0.000 | 0.769 | (0;000) | ✗ | 27/01/17 |
Li2VF6 | ICSD | 290252 | P4_2/mnm (136) | ✔ | 18 | 122 | 1 | 0.0 | 0.000 | 0.711 | (0;110) | ✗ | 27/01/17 |
CaFe(GeO3)2 | ICSD | 290257 | C2/c (15) | ✔ | 20 | 124 | 3 | 0.5341 | 0.535 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba3CdHg10 | ICSD | 290306 | Immm (71) | ✔ | 14 | 162 | 3 | 0.0 | 0.021 | 0.529 | (0;111) | ✗ | 02/02/17 |
Rb2NaAlF6 | ICSD | 290318 | Fm-3m (225) | ✔ | 10 | 72 | 1 | 7.1159 | 7.116 | 0.000 | (0;000) | ✗ | 05/01/17 |
FePO4 | ICSD | 290337 | Pnma (62) | ✔ | 24 | 148 | 3 | 0.0 | 0.001 | 0.184 | (1;011) | ✗ | 04/08/17 |
Ga2HgSe4 | ICSD | 290392 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.9606 | 0.961 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ga2HgSe4 | ICSD | 290393 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.8371 | 0.837 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ga2HgSe4 | ICSD | 290394 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.9364 | 0.936 | 0.000 | (0;000) | ✗ | 06/10/16 |
TaN | ICSD | 290395 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.080 | (1;100) | ✔ | 04/10/16 |
FeSe | ICSD | 290411 | Cmme (67) | ✔ | 4 | 28 | 3 | 0.0 | 0.009 | 0.575 | (1;111) | ✗ | 27/01/17 |
HfN2 | ICSD | 290427 | P-6m2 (187) | ✗ | 3 | 22 | 3 | 0.0 | 0.033 | 0.203 | (0;000) | ✔ | 06/10/16 |
WN2 | ICSD | 290433 | P-6m2 (187) | ✗ | 3 | 24 | 3 | 0.8125 | 1.046 | 0.000 | (0;000) | ✗ | 06/10/16 |
OsN2 | ICSD | 290439 | P-6m2 (187) | ✗ | 3 | 26 | 3 | 0.0 | 0.000 | 0.655 | (0;100) | ✔ | 06/10/16 |
PtN2 | ICSD | 290445 | P-6m2 (187) | ✗ | 3 | 20 | 3 | 0.0 | 0.007 | 0.161 | (1;100) | ✔ | 06/10/16 |
RuO2 | ICSD | 290495 | Pmnn (58) | ✔ | 6 | 56 | 3 | 0.0 | 0.041 | 0.284 | (0;000) | ✗ | 06/10/16 |
KBr | ICSD | 290557 | Pm-3m (221) | ✔ | 2 | 16 | 3 | 2.0789 | 2.113 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaFe2Se3 | ICSD | 290596 | Cmcm (63) | ✔ | 12 | 88 | 1 | 0.0 | 0.001 | 0.469 | (1;000) | ✗ | 02/02/17 |
AgClO4 | ICSD | 290704 | Pnma (62) | ✔ | 24 | 168 | 3 | 2.995 | 2.995 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiVCuO4 | ICSD | 290739 | Imma (74) | ✔ | 14 | 102 | 3 | 0.0 | 0.001 | 0.627 | (1;100) | ✗ | 27/01/17 |
Ca2CrSbO6 | ICSD | 290790 | P2_1/c (14) | ✔ | 20 | 150 | 3 | 7.4056 | 0.000 | 1.000 | (0;000) | ✗ | 21/03/17 |
CaC2 | ICSD | 290833 | C2/m (12) | ✔ | 6 | 36 | 1 | 2.378 | 2.794 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaC2 | ICSD | 290834 | Cmcm (63) | ✔ | 6 | 36 | 1 | 0.0 | 0.051 | 0.065 | (0;000) | ✗ | 06/10/16 |
Sr2MgTeO6 | ICSD | 290893 | C2/m (12) | ✔ | 10 | 72 | 3 | 2.8585 | 2.859 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(GaTe2)2 | ICSD | 290911 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.7463 | 0.848 | 0.000 | (0;000) | ✗ | 06/10/16 |
In2Pd8Se | ICSD | 290932 | P4/mmm (123) | ✔ | 11 | 176 | 3 | 0.0 | 0.005 | 0.482 | (1;111) | ✗ | 27/01/17 |