▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Be2V | ICSD | 58752 | P6_3/mmc (194) | ✔ | 12 | 84 | 3 | 0.0 | 0.004 | 0.370 | (1;000) | ✗ | 05/01/17 |
Ba4Zr(RuO4)3 | ICSD | 47133 | R-3m (166) | ✔ | 20 | 164 | 3 | 0.0 | 0.002 | 0.486 | (0;111) | ✗ | 21/03/17 |
SiO2 | ICSD | 75651 | P4_32_12 (96) | ✗ | 12 | 64 | 3 | 5.7082 | 5.708 | 0.000 | (0;000) | ✗ | 06/10/16 |
NbGaO4 | ICSD | 18187 | C2 (5) | ✗ | 12 | 100 | 3 | 3.5733 | 3.781 | 0.000 | (0;000) | ✗ | 06/10/16 |
SiIr | ICSD | 15693 | Pmnb (62) | ✔ | 8 | 52 | 3 | 0.0 | 0.001 | 0.343 | (0;011) | ✗ | 06/10/16 |
Zr2TlC | ICSD | 618976 | P6_3/mmc (194) | ✔ | 8 | 50 | 3 | 0.0 | 0.000 | 0.968 | (0;000) | ✗ | 27/01/17 |
Ta2C | COD | 8101059 | P-3m1 (164) | ✔ | 3 | 30 | 3 | 0.0 | 0.355 | 0.178 | (1;000) | ✗ | 27/01/17 |
GaPO4 | ICSD | 155445 | C222_1 (20) | ✗ | 12 | 84 | 3 | 4.8585 | 4.859 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaBiO3 | COD | 2101573 | Pba2 (32) | ✗ | 20 | 172 | 3 | 0.0 | 0.079 | 0.415 | ? | ✗ | 21/03/17 |
VIr | ICSD | 104590 | Cmmm (65) | ✔ | 4 | 44 | 3 | 0.0 | 0.012 | 0.614 | (0;111) | ✗ | 06/10/16 |
Ti2TlC | ICSD | 618954 | P6_3/mmc (194) | ✔ | 8 | 82 | 3 | 0.0 | 0.000 | 0.970 | (1;000) | ✗ | 27/01/17 |
GaPO4 | ICSD | 155446 | C222_1 (20) | ✗ | 12 | 84 | 3 | 5.0653 | 5.065 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaFeCuF7 | COD | 1000216 | Cc (9) | ✗ | 20 | 156 | 3 | 0.0 | 0.009 | 0.016 | (0;000) | ✔ | 21/03/17 |
BaSr(FeO2)4 | ICSD | 2536 | P-6m2 (187) | ✗ | 14 | 100 | 3 | 0.0 | 0.000 | 0.839 | ? | ✗ | 21/03/17 |
Ti2C | ICSD | 77473 | Fd-3m (227) | ✔ | 12 | 112 | 3 | 0.0 | 0.012 | 0.367 | (0;000) | ✗ | 27/01/17 |
Hf(CuP)2 | ICSD | 53287 | P-3m1 (164) | ✔ | 5 | 44 | 3 | 0.0 | 0.001 | 0.174 | (1;000) | ✗ | 27/01/17 |
Ba(TlHg)2 | COD | 4104570 | P4_2/mnm (136) | ✔ | 20 | 240 | 3 | 0.0 | 0.002 | 0.730 | (1;000) | ✗ | 21/03/17 |
GaCu2 | ICSD | 627392 | Imma (74) | ✔ | 6 | 70 | 3 | 0.0 | 0.000 | 0.496 | (0;011) | ✗ | 27/01/17 |
SiO2 | ICSD | 75654 | C2/c (15) | ✔ | 12 | 64 | 3 | 5.8229 | 5.859 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaPO4 | ICSD | 97550 | C222_1 (20) | ✗ | 12 | 84 | 3 | 4.5581 | 4.558 | 0.000 | (0;000) | ✗ | 06/10/16 |
IrW | ICSD | 104596 | Pmmb (51) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.746 | (0;001) | ✗ | 06/10/16 |
Ba(MgSn)2 | ICSD | 41915 | P4/nmm (129) | ✔ | 20 | 232 | 3 | 0.0 | 0.004 | 0.429 | (0;001) | ✗ | 21/03/17 |
BaMnO3 | ICSD | 24130 | P6_3/mmc (194) | ✔ | 20 | 172 | 3 | 0.0 | 0.002 | 0.513 | (0;000) | ✗ | 21/03/17 |
BaMoO2 | COD | 5910093 | I4_1/a (88) | ✔ | 16 | 144 | 3 | 0.0 | 0.021 | 0.336 | (1;111) | ✗ | 21/03/17 |
BaNiSn3 | ICSD | 58662 | I4mm (107) | ✗ | 5 | 62 | 3 | 0.0 | 0.004 | 0.383 | (0;110) | ✔ | 21/03/17 |
FeCu2Sn | ICSD | 151206 | Fm-3m (225) | ✔ | 4 | 44 | 3 | 0.0 | 0.035 | 0.715 | (0;000) | ✗ | 27/01/17 |
Ba(RhPb2)3 | ICSD | 58669 | Cmcm (63) | ✔ | 20 | 290 | 3 | 0.0 | 0.000 | 0.940 | (0;110) | ✗ | 21/03/17 |
BaSiPd | ICSD | 616034 | P2_13 (198) | ✗ | 12 | 128 | 3 | 0.0 | 0.000 | 0.481 | ? | ✗ | 21/03/17 |
BaPPt | ICSD | 59191 | P2_13 (198) | ✗ | 12 | 100 | 3 | 0.0 | 0.000 | 0.430 | ? | ✗ | 21/03/17 |
BaSiPt | ICSD | 604438 | P2_13 (198) | ✗ | 12 | 96 | 3 | 0.0 | 0.000 | 0.537 | ? | ✗ | 21/03/17 |
Ba(Sn2Ru)3 | ICSD | 427286 | Cmcm (63) | ✔ | 20 | 284 | 3 | 0.0 | 0.006 | 0.953 | (0;000) | ✗ | 21/03/17 |
BaS3 | COD | 1010269 | P2_12_12 (18) | ✗ | 16 | 112 | 3 | 0.8913 | 0.979 | 0.000 | (0;000) | ✗ | 21/03/17 |
HfBeSi | ICSD | 108103 | P6_3/mmc (194) | ✔ | 6 | 40 | 3 | 0.0 | 0.001 | 0.140 | (1;000) | ✗ | 05/01/17 |
ZrGaRh | ICSD | 635225 | P-62m (189) | ✗ | 9 | 102 | 3 | 0.0 | 0.000 | 0.743 | ? | ✗ | 06/10/16 |
Cu2GeO4 | COD | 1524532 | I4_1/amd (141) | ✔ | 14 | 100 | 3 | 0.0 | 0.001 | 0.845 | (1;111) | ✗ | 27/01/17 |
Co3B | COD | 1511066 | Pnma (62) | ✔ | 16 | 216 | 3 | 0.0 | 0.018 | 0.208 | (1;000) | ✗ | 21/03/17 |
CoBW | COD | 1511056 | Pnma (62) | ✔ | 12 | 136 | 3 | 1.5852 | 0.022 | 1.000 | (0;000) | ✗ | 21/03/17 |
CrB | ICSD | 613476 | I4_1/amd (141) | ✔ | 8 | 68 | 3 | 0.0 | 0.005 | 0.669 | (1;111) | ✗ | 21/03/17 |
TiBe3 | ICSD | 616451 | R-3m (166) | ✔ | 12 | 72 | 3 | 0.0 | 0.003 | 0.794 | (1;000) | ✗ | 21/03/17 |
ZrIr | ICSD | 163453 | Cmcm (63) | ✔ | 8 | 84 | 3 | 0.0 | 0.017 | 0.492 | (1;000) | ✗ | 27/01/17 |
Ga2HgS4 | ICSD | 67220 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7231 | 1.723 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeMo3 | ICSD | 58715 | Pm-3n (223) | ✔ | 8 | 92 | 3 | 0.0 | 0.008 | 0.403 | (0;000) | ✗ | 05/01/17 |
LiBF4 | COD | 1505727 | P3_121 (152) | ✗ | 18 | 102 | 3 | 8.4755 | 8.515 | 0.000 | (0;000) | ✗ | 21/03/17 |
Sr(CuGe)2 | ICSD | 627840 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.016 | 0.796 | (0;000) | ✗ | 27/01/17 |
Hf6Ga2Ni | ICSD | 634312 | P-62m (189) | ✗ | 9 | 108 | 3 | 0.0 | 0.000 | 0.890 | ? | ✗ | 06/10/16 |
ScGaCu2 | COD | 1524876 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.015 | 0.251 | (1;000) | ✗ | 27/01/17 |
InP3 | ICSD | 37073 | R-3m (166) | ✔ | 8 | 56 | 3 | 0.0 | 0.002 | 0.443 | (0;000) | ✗ | 27/01/17 |
CaNb2Bi2O9 | ICSD | 20666 | I4/mmm (139) | ✔ | 14 | 120 | 3 | 0.0 | 0.001 | 0.425 | (0;111) | ✗ | 21/03/17 |
LiIn2Rh | ICSD | 106806 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.002 | 0.869 | (1;000) | ✗ | 27/01/17 |
CaTa2Bi2O9 | ICSD | 20667 | I4/mmm (139) | ✔ | 14 | 120 | 3 | 0.0 | 0.000 | 0.338 | (0;000) | ✗ | 21/03/17 |
MnHO2 | COD | 9009773 | Pnma (62) | ✔ | 16 | 112 | 3 | 0.0 | 0.030 | 0.465 | (0;000) | ✗ | 27/01/17 |
SrHg | COD | 1523313 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.531 | (1;000) | ✗ | 27/01/17 |
MnCo(BiO3)2 | ICSD | 153856 | C2 (5) | ✗ | 20 | 196 | 3 | 0.0 | 0.001 | 0.519 | ? | ✗ | 21/03/17 |
Ti4FeBi2 | ICSD | 150146 | I4/mcm (140) | ✔ | 14 | 172 | 3 | 0.0 | 0.002 | 0.679 | (1;111) | ✗ | 21/03/17 |
GeBi2O5 | COD | 1526265 | Cmc2_1 (36) | ✗ | 16 | 128 | 3 | 2.4247 | 2.535 | 0.000 | (0;000) | ✗ | 21/03/17 |
Zr(CuP)2 | ICSD | 628683 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.0 | 0.035 | 0.238 | (1;000) | ✗ | 27/01/17 |
SiCu2NiS4 | ICSD | 628554 | P2/m (10) | ✔ | 8 | 60 | 3 | 0.0 | 0.006 | 0.578 | (1;011) | ✗ | 27/01/17 |
MgCu2 | COD | 1524810 | Fd-3m (227) | ✔ | 6 | 64 | 3 | 0.0 | 0.000 | 0.731 | (0;000) | ✗ | 27/01/17 |
SiO2 | ICSD | 75657 | C2 (5) | ✗ | 12 | 64 | 3 | 5.553 | 5.591 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ti4Bi2O11 | COD | 2101260 | C2/m (12) | ✔ | 17 | 144 | 3 | 2.0813 | 2.516 | 0.000 | (0;000) | ✗ | 21/03/17 |
Bi2O3 | COD | 9012328 | P-4b2 (117) | ✗ | 20 | 192 | 3 | 0.0 | 0.000 | 0.728 | ? | ✗ | 21/03/17 |
SiBi2O5 | ICSD | 30995 | Cmc2_1 (36) | ✗ | 16 | 128 | 3 | 2.5658 | 2.632 | 0.000 | (0;000) | ✗ | 21/03/17 |
Ga2HgS4 | ICSD | 189737 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7261 | 1.726 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2Pd3S2 | ICSD | 417634 | I2_13 (199) | ✗ | 14 | 192 | 3 | 0.0 | 0.000 | 0.820 | ? | ✗ | 21/03/17 |
NaV2Bi3O10 | ICSD | 88455 | P1 (1) | ✗ | 16 | 140 | 3 | 1.6199 | 1.676 | 0.000 | (0;000) | ✗ | 21/03/17 |
ZrBeSi | ICSD | 76123 | P6_3/mmc (194) | ✔ | 6 | 24 | 3 | 0.0 | 0.006 | 0.162 | (1;000) | ✗ | 05/01/17 |
Ta2GaC | ICSD | 617926 | P6_3/mmc (194) | ✔ | 8 | 86 | 3 | 0.0 | 0.000 | 0.886 | (1;000) | ✗ | 27/01/17 |
Bi4S3 | COD | 9013958 | R-3m (166) | ✔ | 7 | 78 | 3 | 0.0 | 0.056 | 0.304 | (1;111) | ✗ | 21/03/17 |
Ta2Be | ICSD | 58738 | I4/mcm (140) | ✔ | 6 | 60 | 3 | 0.0 | 0.005 | 0.340 | (1;000) | ✗ | 05/01/17 |
Ga2HgS4 | ICSD | 189738 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.6944 | 1.694 | 0.000 | (0;000) | ✗ | 06/10/16 |
MnBiS2Cl | ICSD | 172156 | Pnma (62) | ✔ | 20 | 196 | 3 | 0.0 | 0.000 | 0.355 | (1;011) | ✗ | 21/03/17 |
KBiF6 | ICSD | 25025 | P-4c2 (116) | ✗ | 16 | 132 | 3 | 1.1363 | 1.136 | 0.000 | (0;000) | ✗ | 21/03/17 |
MnCu2Sb | ICSD | 53312 | Fm-3m (225) | ✔ | 4 | 42 | 3 | 0.0 | 0.025 | 0.543 | (0;000) | ✗ | 27/01/17 |
LiY(CuP)2 | ICSD | 628287 | P-3m1 (164) | ✔ | 6 | 46 | 3 | 0.0 | 0.370 | 0.150 | (0;000) | ✗ | 27/01/17 |
BiIrS | ICSD | 616740 | P2_13 (198) | ✗ | 12 | 152 | 3 | 0.6388 | 1.147 | 0.000 | (0;000) | ✗ | 21/03/17 |
Ga2HgS4 | ICSD | 189739 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7259 | 1.726 | 0.000 | (0;000) | ✗ | 06/10/16 |
KBi(PSe3)2 | ICSD | 90153 | P2_1 (4) | ✗ | 20 | 140 | 3 | 1.2488 | 1.327 | 0.000 | (0;000) | ✗ | 21/03/17 |
AgCl | ICSD | 56541 | P2_1/m (11) | ✔ | 4 | 36 | 3 | 0.6845 | 2.523 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiMoO2 | COD | 2000338 | I4_1/a (88) | ✔ | 16 | 164 | 3 | 0.0 | 0.023 | 0.324 | (1;111) | ✗ | 21/03/17 |
NiBiSe | ICSD | 616878 | P2_13 (198) | ✗ | 12 | 124 | 3 | 0.0 | 0.000 | 0.635 | ? | ✗ | 21/03/17 |
ScBiO3 | COD | 4123993 | C2 (5) | ✗ | 20 | 176 | 3 | 2.1205 | 2.349 | 0.000 | (0;000) | ✗ | 21/03/17 |
BiPO4 | COD | 9008088 | P3_121 (152) | ✗ | 18 | 132 | 3 | 3.0778 | 3.125 | 0.000 | (0;000) | ✗ | 21/03/17 |
TlBi(PS3)2 | COD | 4307993 | P2_1 (4) | ✗ | 20 | 148 | 3 | 1.2092 | 1.323 | 0.000 | (0;000) | ✗ | 21/03/17 |
BiPtPb3 | ICSD | 58834 | P4_2/mnm (136) | ✔ | 20 | 268 | 3 | 0.0 | 0.001 | 0.923 | (1;000) | ✗ | 21/03/17 |
BiPd2Pb | COD | 9012389 | Cmc2_1 (36) | ✗ | 16 | 260 | 3 | 0.0 | 0.008 | 0.842 | ? | ✗ | 21/03/17 |
BiPd | COD | 9012856 | Cmc2_1 (36) | ✗ | 16 | 264 | 3 | 0.0 | 0.001 | 0.869 | ? | ✗ | 21/03/17 |
BiPdSe | ICSD | 616956 | P2_13 (198) | ✗ | 12 | 156 | 3 | 0.0 | 0.000 | 0.613 | ? | ✗ | 21/03/17 |
BiPtSe | ICSD | 616991 | P2_13 (198) | ✗ | 12 | 124 | 3 | 0.0 | 0.000 | 0.649 | ? | ✗ | 21/03/17 |
MgCu2O3 | COD | 2002199 | Pmmn (59) | ✔ | 12 | 100 | 3 | 0.0 | 0.005 | 0.977 | (0;000) | ✗ | 27/01/17 |
LiBPt3 | COD | 1511220 | P-62m (189) | ✗ | 15 | 108 | 3 | 0.0 | 0.000 | 0.810 | ? | ✗ | 21/03/17 |
Ga2HgS4 | ICSD | 189740 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.8647 | 1.865 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiCu2Sn | ICSD | 150602 | P6_3/mmc (194) | ✔ | 8 | 78 | 3 | 0.0 | 0.000 | 0.791 | (0;000) | ✗ | 27/01/17 |
Hg3(TeBr)2 | ICSD | 27402 | I2_13 (199) | ✗ | 14 | 124 | 3 | 1.8149 | 1.863 | 0.000 | (0;000) | ✗ | 21/03/17 |
SiO2 | ICSD | 75665 | Pm (6) | ✗ | 12 | 64 | 3 | 3.8179 | 4.380 | 0.000 | (0;000) | ✗ | 06/10/16 |
LaNi | ICSD | 641489 | Ccmm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.851 | (1;110) | ✗ | 06/10/16 |
CsPbBr3 | COD | 1530681 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 0.401 | 0.401 | 0.000 | (1;111) | ✗ | 21/03/17 |
Ga2HgS4 | ICSD | 189741 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.0214 | 2.021 | 0.000 | (0;000) | ✗ | 06/10/16 |
Fe2NiB | ICSD | 614129 | Pnma (62) | ✔ | 16 | 116 | 3 | 0.0 | 0.000 | 0.593 | (1;110) | ✗ | 05/01/17 |
Fe3B | ICSD | 260757 | Pnma (62) | ✔ | 16 | 108 | 3 | 0.0 | 0.000 | 0.611 | (0;110) | ✗ | 05/01/17 |
Ga2HgS4 | ICSD | 189742 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.1342 | 2.134 | 0.000 | (0;000) | ✗ | 06/10/16 |