▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cs3NiO2 | ICSD | 424578 | P4_2/mnm (136) | ✔ | 12 | 98 | 3 | 0.0 | 0.000 | 0.766 | (0;000) | ✗ | 02/02/17 |
KFeSe2 | ICSD | 40780 | C2/c (15) | ✔ | 8 | 58 | 1 | 0.0 | 0.000 | 0.500 | (1;101) | ✗ | 02/02/17 |
Hf4FeP | ICSD | 632255 | P4/mcc (124) | ✔ | 12 | 122 | 3 | 0.0 | 0.000 | 0.836 | (0;110) | ✗ | 02/02/17 |
YGaIr | ICSD | 634463 | Pnma (62) | ✔ | 12 | 164 | 3 | 0.0 | 0.003 | 0.783 | (0;011) | ✗ | 02/02/17 |
Mn3V2Si3 | ICSD | 643689 | P6_3/mcm (193) | ✔ | 16 | 166 | 3 | 0.0 | 0.000 | 0.773 | (1;001) | ✗ | 02/02/17 |
Ga3Ni5Sn2 | ICSD | 634933 | Cmcm (63) | ✔ | 20 | 234 | 3 | 0.0 | 0.000 | 0.987 | (1;000) | ✗ | 02/02/17 |
Sr4Fe4O11 | COD | 1521171 | Cmmm (65) | ✔ | 19 | 138 | 3 | 0.0 | 0.003 | 0.601 | (1;001) | ✗ | 02/02/17 |
SiO2 | ICSD | 155250 | P3_221 (154) | ✗ | 9 | 48 | 3 | 0.0 | 0.000 | 0.007 | (0;000) | ✔ | 15/02/17 |
Li2InAg | COD | 1509395 | F-43m (216) | ✗ | 4 | 30 | 3 | 0.0 | 0.000 | 0.847 | ? | ✗ | 15/02/17 |
K3V3O8 | COD | 1523955 | P-3m1 (164) | ✔ | 14 | 114 | 2 | 0.0 | 0.027 | 0.580 | (0;000) | ✗ | 02/02/17 |
HfTl2PbSe4 | ICSD | 237510 | C2/c (15) | ✔ | 16 | 152 | 3 | 0.0 | 1.220 | 0.059 | (0;000) | ✗ | 02/02/17 |
Hf4NiP | ICSD | 638708 | P4/mcc (124) | ✔ | 12 | 126 | 3 | 0.0 | 0.000 | 0.515 | (0;110) | ✗ | 02/02/17 |
Mn(SbS2)2 | ICSD | 411178 | C2/m (12) | ✔ | 14 | 98 | 2 | 0.0 | 0.003 | 0.498 | (1;111) | ✗ | 02/02/17 |
SrHg3 | ICSD | 247136 | P6_3/mmc (194) | ✔ | 8 | 92 | 3 | 0.0 | 0.002 | 0.468 | (1;000) | ✗ | 02/02/17 |
Y12Ni6Pb | ICSD | 54614 | Im3 (204) | ✔ | 19 | 206 | 3 | 0.0 | 0.000 | 0.506 | (1;000) | ✗ | 02/02/17 |
In2Te | ICSD | 640618 | Pnnm (58) | ✔ | 24 | 256 | 3 | 0.0 | 0.019 | 0.909 | (1;000) | ✗ | 04/08/17 |
Y5CuPb3 | ICSD | 107005 | P6_3/mcm (193) | ✔ | 18 | 216 | 3 | 0.0 | 0.001 | 0.856 | (1;000) | ✗ | 02/02/17 |
CdInGaS4 | ICSD | 2465 | P3m1 (156) | ✗ | 7 | 62 | 2 | 0.0 | 0.009 | 0.128 | (1;000) | ✔ | 22/03/17 |
LiAlSi | ICSD | 413257 | F-43m (216) | ✗ | 3 | 10 | 3 | 0.0 | 1.721 | 0.008 | (0;000) | ✔ | 15/02/17 |
Al4Cu2O7 | COD | 2002328 | F-43m (216) | ✗ | 13 | 76 | 3 | 0.0 | 0.000 | 0.247 | (1;000) | ✔ | 26/04/17 |
Cr3C | ICSD | 617486 | Pnma (62) | ✔ | 16 | 184 | 3 | 0.0 | 0.011 | 0.371 | (1;000) | ✗ | 22/03/17 |
Sc7P3 | ICSD | 648099 | P6_3mc (186) | ✗ | 20 | 184 | 3 | 0.0 | 0.000 | 0.821 | ? | ✗ | 29/03/17 |
BW2 | COD | 1511333 | I4/mcm (140) | ✔ | 6 | 118 | 3 | 0.0 | 0.000 | 0.564 | (1;000) | ✗ | 11/04/17 |
VSn2 | COD | 1528218 | Fddd (70) | ✔ | 12 | 164 | 3 | 0.0 | 0.010 | 0.598 | (1;111) | ✗ | 02/02/17 |
KV5S8 | ICSD | 602318 | C2/m (12) | ✔ | 14 | 122 | 3 | 0.0 | 0.011 | 0.760 | (0;001) | ✗ | 02/02/17 |
Sn3Pt2 | COD | 1522860 | P6_3/mmc (194) | ✔ | 10 | 124 | 3 | 0.0 | 0.022 | 0.721 | (1;000) | ✗ | 02/02/17 |
K2Mg5Sn3 | ICSD | 421342 | I4/mmm (139) | ✔ | 10 | 110 | 1 | 0.0 | 0.014 | 0.150 | (0;000) | ✗ | 02/02/17 |
Sr4Mg3Al5 | COD | 4311323 | P6_3/mmc (194) | ✔ | 24 | 170 | 1 | 0.0 | 0.000 | 0.897 | (0;000) | ✗ | 04/08/17 |
Hf2InCu2 | ICSD | 130032 | P4/mbm (127) | ✔ | 10 | 118 | 3 | 0.0 | 0.000 | 0.987 | (1;110) | ✗ | 02/02/17 |
Y2Zn17 | COD | 1522899 | R-3m (166) | ✔ | 19 | 226 | 3 | 0.0 | 0.000 | 0.513 | (1;000) | ✗ | 02/02/17 |
Sr(Sb3Ru)4 | ICSD | 42962 | Im3 (204) | ✔ | 17 | 134 | 3 | 0.0 | 0.029 | 0.455 | (0;000) | ✗ | 02/02/17 |
Ta3CrSe6 | ICSD | 626727 | P6_322 (182) | ✗ | 20 | 178 | 3 | 0.0 | 0.001 | 0.761 | ? | ✗ | 22/03/17 |
Zr2Ni2Sn | ICSD | 405564 | P4_2/mnm (136) | ✔ | 20 | 168 | 3 | 0.0 | 0.008 | 0.422 | (0;000) | ✗ | 02/02/17 |
SrSn3 | ICSD | 410956 | R-3m (166) | ✔ | 16 | 208 | 3 | 0.0 | 0.028 | 0.516 | (1;111) | ✗ | 02/02/17 |
TlTe3Pt2 | ICSD | 78787 | P-3m1 (164) | ✔ | 12 | 102 | 3 | 0.0 | 0.261 | 0.145 | (0;000) | ✗ | 02/02/17 |
Mn4As3 | ICSD | 80375 | C2/m (12) | ✔ | 14 | 150 | 3 | 0.0 | 0.003 | 0.608 | (1;111) | ✗ | 21/03/17 |
HfCoSb | ICSD | 108294 | F-43m (216) | ✗ | 3 | 34 | 3 | 0.0 | 0.378 | 0.134 | (0;000) | ✔ | 15/02/17 |
Li2GaIr | ICSD | 107085 | F-43m (216) | ✗ | 4 | 36 | 3 | 0.0 | 0.051 | 0.669 | ? | ✗ | 15/02/17 |
Ga2Fe2S5 | ICSD | 49912 | P6_3/mmc (194) | ✔ | 18 | 144 | 2 | 0.0 | 0.040 | 0.189 | (0;000) | ✗ | 02/02/17 |
Sr2MnCuSO3 | ICSD | 91199 | P4/nmm (129) | ✔ | 16 | 140 | 1 | 0.0 | 0.003 | 0.963 | (0;001) | ✗ | 02/02/17 |
KMnF3 | ICSD | 89343 | P2_1/m (11) | ✔ | 20 | 180 | 3 | 0.0 | 0.006 | 0.776 | (0;011) | ✗ | 02/02/17 |
CuTeO3 | COD | 1530570 | P2_1/c (14) | ✔ | 20 | 140 | 3 | 0.0 | 0.011 | 0.099 | (1;000) | ✗ | 02/02/17 |
YZnGe | ICSD | 163345 | P6_3/mmc (194) | ✔ | 12 | 108 | 3 | 0.0 | 0.005 | 0.471 | (1;000) | ✗ | 02/02/17 |
SrSbSe2F | ICSD | 171430 | P4/nmm (129) | ✔ | 10 | 68 | 1 | 0.0 | 0.024 | 0.007 | (0;000) | ✗ | 02/02/17 |
Hf2In5 | ICSD | 404531 | P4/mbm (127) | ✔ | 14 | 178 | 3 | 0.0 | 0.000 | 0.923 | (1;000) | ✗ | 02/02/17 |
Ge3Mo5 | ICSD | 637143 | P6_3/mcm (193) | ✔ | 16 | 164 | 3 | 0.0 | 0.002 | 0.955 | (0;000) | ✗ | 02/02/17 |
TiGeRu | ICSD | 637762 | Ima2 (46) | ✗ | 18 | 192 | 3 | 0.0 | 0.025 | 0.584 | ? | ✗ | 22/03/17 |
Zr5SiPb3 | ICSD | 604195 | P6_3/mcm (193) | ✔ | 18 | 132 | 3 | 0.0 | 0.001 | 0.630 | (0;000) | ✗ | 02/02/17 |
Zr3Pd4 | ICSD | 186415 | R-3 (148) | ✔ | 14 | 168 | 3 | 0.0 | 0.000 | 0.709 | (1;000) | ✗ | 02/02/17 |
MgNi3B2 | ICSD | 156018 | P6_422 (181) | ✗ | 18 | 138 | 3 | 0.0 | 0.000 | 0.428 | ? | ✗ | 15/02/17 |
Ta5Ge3 | ICSD | 44744 | I4/mcm (140) | ✔ | 16 | 154 | 3 | 0.0 | 0.000 | 0.785 | (1;000) | ✗ | 02/02/17 |
Zr5FePb3 | ICSD | 604198 | P6_3/mcm (193) | ✔ | 18 | 140 | 3 | 0.0 | 0.004 | 0.678 | (1;000) | ✗ | 02/02/17 |
TiS3 | ICSD | 41235 | R3m (160) | ✗ | 4 | 30 | 1 | 0.0 | 0.000 | 0.227 | (0;000) | ✔ | 11/04/17 |
Sb2Te3 | ICSD | 262172 | C2/m (12) | ✔ | 10 | 56 | 3 | 0.0 | 0.037 | 0.556 | (0;000) | ✗ | 02/02/17 |
Hf5ZnSb3 | ICSD | 42913 | P6_3/mcm (193) | ✔ | 18 | 174 | 3 | 0.0 | 0.000 | 0.789 | (1;000) | ✗ | 02/02/17 |
ReO3 | COD | 1523942 | Im3 (204) | ✔ | 16 | 132 | 3 | 0.0 | 0.000 | 0.902 | (0;111) | ✗ | 02/02/17 |
W2C | ICSD | 108194 | Pbcn (60) | ✔ | 12 | 240 | 3 | 0.0 | 0.024 | 0.397 | (1;000) | ✗ | 11/04/17 |
NaFe(GeO3)2 | ICSD | 180305 | C2/c (15) | ✔ | 20 | 122 | 3 | 0.0 | 0.000 | 0.291 | (1;101) | ✗ | 02/02/17 |
TlO2 | ICSD | 16230 | Pnnm (58) | ✔ | 18 | 150 | 3 | 0.0 | 0.000 | 0.926 | (0;110) | ✗ | 02/02/17 |
Cu6PbO8 | COD | 2102004 | Fm-3m (225) | ✔ | 15 | 128 | 3 | 0.0 | 0.006 | 0.271 | (0;000) | ✗ | 02/02/17 |
RbPbF3 | ICSD | 161148 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.0 | 0.011 | 0.578 | (0;000) | ✗ | 02/02/17 |
Al5C3N | COD | 2310415 | P6_3mc (186) | ✗ | 18 | 64 | 3 | 0.0 | 0.726 | 0.092 | (0;000) | ✔ | 24/04/17 |
Zr5Sn3P | ICSD | 656295 | P6_3/mcm (193) | ✔ | 18 | 134 | 3 | 0.0 | 0.000 | 0.681 | (0;000) | ✗ | 02/02/17 |
CsSO3 | COD | 9015381 | P-62c (190) | ✗ | 20 | 132 | 3 | 0.0 | 0.025 | 0.071 | (0;000) | ✔ | 24/04/17 |
Hf3P2 | COD | 2005341 | Pnma (62) | ✔ | 20 | 184 | 3 | 0.0 | 0.020 | 0.449 | (1;000) | ✗ | 02/02/17 |
Ti4FeS8 | COD | 9012119 | C2/m (12) | ✔ | 13 | 104 | 3 | 0.0 | 0.016 | 0.502 | (0;001) | ✗ | 02/02/17 |
SiS4 | ICSD | 59708 | P2_1/m (11) | ✔ | 10 | 56 | 1 | 0.0 | 0.017 | 0.532 | (0;010) | ✗ | 02/02/17 |
NF2 | COD | 9016398 | Pmna (53) | ✔ | 12 | 76 | 1 | 0.0 | 0.004 | 0.376 | (1;011) | ✗ | 22/03/17 |
Rb(MoS)3 | ICSD | 30753 | P6_3/m (176) | ✔ | 14 | 138 | 1 | 0.0 | 0.000 | 0.273 | (0;000) | ✗ | 02/02/17 |
Y3Al3NiGe2 | ICSD | 76297 | P-62m (189) | ✗ | 9 | 60 | 3 | 0.0 | 0.000 | 0.624 | ? | ✗ | 15/02/17 |
Nb2Bi2PbO9 | ICSD | 61008 | I4/mmm (139) | ✔ | 14 | 124 | 2 | 0.0 | 1.025 | 0.136 | (0;000) | ✗ | 21/03/17 |
CuAsSe | ICSD | 610356 | Pna2_1 (33) | ✗ | 12 | 88 | 3 | 0.0 | 0.031 | 0.192 | (1;000) | ✔ | 21/03/17 |
CsFe2S3 | COD | 9013450 | Cmcm (63) | ✔ | 12 | 86 | 1 | 0.0 | 0.000 | 0.306 | (0;110) | ✗ | 02/02/17 |
Cs3Pb4Au | ICSD | 107448 | Pmmn (59) | ✔ | 16 | 188 | 1 | 0.0 | 0.030 | 0.340 | (0;000) | ✗ | 21/03/17 |
Cr3C2 | ICSD | 653958 | Pnma (62) | ✔ | 20 | 200 | 3 | 0.0 | 0.004 | 0.700 | (1;000) | ✗ | 21/03/17 |
Sc(FeSi)2 | ICSD | 633456 | Pbcm (57) | ✔ | 20 | 140 | 3 | 0.0 | 0.000 | 0.494 | (0;000) | ✗ | 02/02/17 |
Nb4B3C2 | ICSD | 411623 | Cmcm (63) | ✔ | 18 | 138 | 3 | 0.0 | 0.000 | 0.957 | (0;110) | ✗ | 21/03/17 |
Sr2YIrO6 | ICSD | 88154 | P2_1/c (14) | ✔ | 20 | 168 | 3 | 0.0 | 0.013 | 0.129 | (0;000) | ✗ | 02/02/17 |
Fe2Re3 | ICSD | 108565 | P4_132 (213) | ✗ | 20 | 244 | 3 | 0.0 | 0.000 | 0.588 | ? | ✗ | 22/03/17 |
Ag2SnHgSe4 | ICSD | 95094 | Pmn2_1 (31) | ✗ | 16 | 144 | 3 | 0.0 | 0.042 | 0.026 | (1;000) | ✔ | 24/04/17 |
Hf5CuSn3 | ICSD | 107310 | P6_3/mcm (193) | ✔ | 18 | 226 | 3 | 0.0 | 0.000 | 0.981 | (0;000) | ✗ | 02/02/17 |
CaFeO2 | ICSD | 246244 | P-42_1m (113) | ✗ | 8 | 60 | 1 | 0.0 | 0.001 | 0.641 | ? | ✗ | 15/02/17 |
CaMnF5 | COD | 1518174 | C2/c (15) | ✔ | 14 | 120 | 1 | 0.0 | 0.002 | 0.361 | (0;000) | ✗ | 04/08/17 |
BW | COD | 9008954 | I4_1/amd (141) | ✔ | 8 | 68 | 3 | 0.0 | 0.008 | 1.000 | (1;111) | ✗ | 21/03/17 |
Sn | ICSD | 35503 | C2/m (12) | ✔ | 1 | 14 | 1 | 0.0 | 0.300 | 0.504 | (0;000) | ✗ | 02/02/17 |
Sr3Fe2Cu2Se2O5 | ICSD | 154203 | I4/mmm (139) | ✔ | 14 | 110 | 1 | 0.0 | 0.001 | 0.694 | (0;111) | ✗ | 22/03/17 |
Cs2CoSiO4 | ICSD | 93878 | Cmc2_1 (36) | ✗ | 16 | 126 | 3 | 0.0 | 0.000 | 0.720 | ? | ✗ | 22/03/17 |
Ca6Cu2Sn7 | COD | 4310163 | C2/m (12) | ✔ | 15 | 180 | 3 | 0.0 | 0.009 | 0.739 | (1;110) | ✗ | 21/03/17 |
Mg3Al8FeSi6 | ICSD | 27140 | P-62m (189) | ✗ | 18 | 86 | 3 | 0.0 | 0.000 | 0.543 | ? | ✗ | 16/03/17 |
In2Fe2Se5 | ICSD | 155025 | P-3m1 (164) | ✔ | 18 | 144 | 1 | 0.0 | 0.009 | 0.778 | (1;000) | ✗ | 02/02/17 |
IBrO | COD | 9009193 | Pmmn (59) | ✔ | 6 | 40 | 2 | 0.0 | 0.022 | 0.474 | (0;000) | ✗ | 21/03/17 |
SnPS3 | ICSD | 648056 | C2/m (12) | ✔ | 10 | 74 | 2 | 0.0 | 0.016 | 0.440 | (0;000) | ✗ | 02/02/17 |
Hf3Ni7 | ICSD | 2417 | P-1 (2) | ✔ | 20 | 212 | 3 | 0.0 | 0.019 | 0.727 | (0;110) | ✗ | 02/02/17 |
F2 | COD | 9012465 | Pm-3n (223) | ✔ | 8 | 56 | 1 | 0.0 | 0.000 | 0.909 | (1;000) | ✗ | 02/02/17 |
Cu(RhS2)2 | COD | 9012162 | Fd-3m (227) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.589 | (0;000) | ✗ | 02/02/17 |
HfGa2 | COD | 1522868 | I4_1/amd (141) | ✔ | 12 | 152 | 3 | 0.0 | 0.032 | 0.505 | (1;111) | ✗ | 02/02/17 |
YSiRh | ICSD | 650347 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.030 | 0.538 | (1;000) | ✗ | 02/02/17 |
KMnF3 | ICSD | 31821 | Pnma (62) | ✔ | 20 | 180 | 3 | 0.0 | 0.002 | 0.510 | (0;110) | ✗ | 02/02/17 |
HNF2 | COD | 9016159 | Pmna (53) | ✔ | 16 | 80 | 1 | 0.0 | 0.002 | 0.279 | (0;000) | ✗ | 02/02/17 |
Tl(MoSe)3 | ICSD | 603627 | P6_3/m (176) | ✔ | 14 | 146 | 3 | 0.0 | 0.000 | 0.303 | (0;000) | ✗ | 02/02/17 |