▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cu2HgI4 | ICSD | 25591 | I-42m (121) | ✗ | 7 | 62 | 3 | 0.5039 | 0.504 | 0.000 | (0;000) | ✗ | 07/10/16 |
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 |
Cu2HgI4 | ICSD | 30265 | P-42m (111) | ✗ | 7 | 62 | 3 | 0.3564 | 0.393 | 0.000 | (0;000) | ✔ | 07/10/16 |
NbAs2 | ICSD | 18143 | C2 (5) | ✗ | 6 | 46 | 3 | 0.0 | 0.010 | 0.093 | (0;111) | ✔ | 04/10/16 |
FeS | ICSD | 68847 | Cmc2_1 (36) | ✗ | 4 | 28 | 3 | 0.0 | 0.028 | 0.242 | (0;000) | ✔ | 06/10/16 |
Al2HgS4 | ICSD | 25635 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.2212 | 2.221 | 0.000 | (0;000) | ✗ | 06/10/16 |
VCu3O4 | ICSD | 418372 | I-42m (121) | ✗ | 8 | 70 | 3 | 0.0 | 0.031 | 0.057 | (0;000) | ✔ | 07/10/16 |
Pb2O | COD | 1010382 | Pn-3m (224) | ✔ | 6 | 68 | 3 | 0.0 | 0.000 | 0.208 | (0;111) | ✗ | 27/01/17 |
Cu3SbS4 | ICSD | 2857 | I-42m (121) | ✗ | 8 | 62 | 3 | 0.0 | 0.038 | 0.105 | (1;000) | ✔ | 07/10/16 |
Al2HgSe4 | ICSD | 183396 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.582 | 1.582 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cu3SbSe4 | ICSD | 400652 | I-42m (121) | ✗ | 8 | 62 | 3 | 0.0 | 0.005 | 0.232 | (1;000) | ✔ | 07/10/16 |
Pd2O | ICSD | 77651 | Pn-3m (224) | ✔ | 6 | 84 | 3 | 0.0 | 0.000 | 0.351 | (0;111) | ✗ | 27/01/17 |
Ti(CuS)4 | ICSD | 82558 | I-42m (121) | ✗ | 9 | 80 | 3 | 1.4281 | 1.713 | 0.000 | (0;000) | ✗ | 07/10/16 |
PdO | COD | 1009031 | P4_2/mmc (131) | ✔ | 4 | 48 | 3 | 0.0 | 0.018 | 0.125 | (0;000) | ✗ | 27/01/17 |
MoP2 | ICSD | 37222 | Ccm2_1 (36) | ✗ | 6 | 48 | 3 | 0.0 | 0.301 | 0.230 | (1;000) | ✔ | 04/10/16 |
PtO | COD | 1522314 | Fm-3m (225) | ✔ | 2 | 16 | 3 | 0.0 | 0.002 | 0.609 | (0;000) | ✗ | 27/01/17 |
Rb2O | COD | 9009067 | Fm-3m (225) | ✔ | 3 | 24 | 3 | 1.4925 | 2.158 | 0.000 | (0;000) | ✗ | 27/01/17 |
Al2HgSe4 | ICSD | 183502 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.5998 | 1.600 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ga2FeSe4 | ICSD | 631817 | P-42m (111) | ✗ | 7 | 58 | 3 | 0.0 | 0.005 | 0.476 | (1;010) | ✔ | 07/10/16 |
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 |
LiFeP | ICSD | 187135 | I4mm (107) | ✗ | 3 | 16 | 3 | 0.0 | 1.023 | 0.012 | (0;000) | ✔ | 07/10/16 |
Al2HgSe4 | ICSD | 25638 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.5826 | 1.583 | 0.000 | (0;000) | ✗ | 06/10/16 |
Hf2GaSb3 | ICSD | 189076 | P-4m2 (115) | ✗ | 6 | 52 | 3 | 0.0 | 0.015 | 0.794 | (0;100) | ✔ | 07/10/16 |
LiGaTe2 | ICSD | 162555 | I-42d (122) | ✗ | 8 | 56 | 3 | 1.4715 | 1.509 | 0.000 | (0;000) | ✗ | 07/10/16 |
Os | COD | 9008510 | P6_3/mmc (194) | ✔ | 2 | 32 | 3 | 0.0 | 0.016 | 0.519 | (0;000) | ✗ | 27/01/17 |
P2Os | COD | 9012560 | Pnnm (58) | ✔ | 6 | 52 | 3 | 0.6977 | 0.981 | 0.000 | (0;000) | ✗ | 27/01/17 |
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 |
Cd(SbO3)2 | ICSD | 71028 | P-31m (162) | ✔ | 9 | 58 | 3 | 0.9839 | 1.275 | 0.000 | (0;000) | ✗ | 27/01/17 |
OsS2 | COD | 9008419 | Pa3 (205) | ✔ | 12 | 112 | 3 | 0.0312 | 0.145 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sb2Os | COD | 9012562 | Pnnm (58) | ✔ | 6 | 52 | 3 | 0.3674 | 0.980 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrSiOs | ICSD | 647807 | Pnma (62) | ✔ | 12 | 96 | 3 | 0.0 | 0.055 | 0.317 | (1;000) | ✗ | 27/01/17 |
TiOs | COD | 1523502 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.011 | 0.242 | (0;111) | ✗ | 27/01/17 |
ZrSO | ICSD | 36111 | P4/nmm (129) | ✔ | 6 | 32 | 3 | 0.8081 | 0.808 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrOs | COD | 1523503 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.110 | 0.248 | (1;111) | ✗ | 27/01/17 |
Ti2O | ICSD | 24081 | P-3m1 (164) | ✔ | 3 | 30 | 3 | 0.0 | 0.025 | 0.314 | (0;000) | ✗ | 27/01/17 |
ZrTi2O | COD | 1525860 | Cmmm (65) | ✔ | 8 | 68 | 3 | 0.0 | 0.003 | 0.640 | (1;110) | ✗ | 27/01/17 |
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 |
TiO | COD | 9016272 | C2/m (12) | ✔ | 10 | 90 | 3 | 0.0 | 0.007 | 0.640 | (1;000) | ✗ | 27/01/17 |
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 |
ZrO | COD | 9008779 | Fm-3m (225) | ✔ | 2 | 10 | 3 | 0.0 | 0.000 | 0.469 | (0;000) | ✗ | 27/01/17 |
FeS2 | ICSD | 42726 | P2nn (34) | ✗ | 6 | 40 | 3 | 0.7907 | 1.143 | 0.000 | (0;000) | ✗ | 06/10/16 |
P2Pt | COD | 9015563 | Pa3 (205) | ✔ | 12 | 80 | 3 | 1.0589 | 1.460 | 0.000 | (0;000) | ✗ | 27/01/17 |
Al2HgSe4 | ICSD | 33827 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.5688 | 1.569 | 0.000 | (0;000) | ✗ | 06/10/16 |
P2Rh | ICSD | 42615 | P2_1/c (14) | ✔ | 12 | 108 | 3 | 0.6698 | 0.670 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(GaS2)2 | ICSD | 635300 | P-42m (111) | ✗ | 7 | 62 | 3 | 1.9326 | 1.933 | 0.000 | (0;000) | ✗ | 07/10/16 |
P2Ru | COD | 9012557 | Pnnm (58) | ✔ | 6 | 52 | 3 | 0.369 | 1.245 | 0.000 | (0;000) | ✗ | 27/01/17 |
SiP2 | ICSD | 30693 | Pa3 (205) | ✔ | 12 | 56 | 3 | 0.0 | 0.924 | 0.248 | (0;000) | ✗ | 27/01/17 |
Ga2TeSe2 | ICSD | 64617 | I4_1md (109) | ✗ | 10 | 88 | 3 | 1.673 | 1.679 | 0.000 | (0;000) | ✗ | 07/10/16 |
TiP2 | ICSD | 24351 | Pnma (62) | ✔ | 12 | 88 | 3 | 0.0 | 0.009 | 0.089 | (1;000) | ✗ | 27/01/17 |
Zn3P2 | COD | 1010126 | Pn-3m (224) | ✔ | 10 | 92 | 3 | 0.0 | 0.004 | 0.124 | (0;000) | ✗ | 27/01/17 |
ZrP2 | ICSD | 24352 | Pnma (62) | ✔ | 12 | 56 | 3 | 0.0 | 0.014 | 0.085 | (1;000) | ✗ | 27/01/17 |
Al2HgTe4 | ICSD | 25641 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.0557 | 1.056 | 0.000 | (0;000) | ✗ | 06/10/16 |
MgGeP2 | ICSD | 182369 | I-42d (122) | ✗ | 8 | 48 | 3 | 1.4973 | 1.529 | 0.000 | (0;000) | ✗ | 07/10/16 |
V5P3 | ICSD | 648274 | P6_3/mcm (193) | ✔ | 16 | 160 | 3 | 0.0 | 0.001 | 0.602 | (0;000) | ✗ | 27/01/17 |
Zr3GeO8 | ICSD | 29263 | I-42m (121) | ✗ | 12 | 64 | 3 | 3.8494 | 4.000 | 0.000 | (0;000) | ✗ | 07/10/16 |
Ti2Cd | COD | 1525205 | I4/mmm (139) | ✔ | 3 | 36 | 3 | 0.0 | 0.003 | 0.217 | (1;111) | ✗ | 27/01/17 |
PdPb2 | COD | 1524520 | I4/mcm (140) | ✔ | 6 | 92 | 3 | 0.0 | 0.009 | 0.603 | (0;000) | ✗ | 27/01/17 |
PtPb2 | ICSD | 54316 | I4/mcm (140) | ✔ | 6 | 76 | 3 | 0.0 | 0.050 | 0.588 | (1;111) | ✗ | 27/01/17 |
RhPb2 | COD | 1524519 | I4/mcm (140) | ✔ | 6 | 90 | 3 | 0.0 | 0.000 | 0.660 | (1;111) | ✗ | 27/01/17 |
YPb2 | COD | 1523371 | Cmcm (63) | ✔ | 6 | 78 | 3 | 0.0 | 0.000 | 0.685 | (0;000) | ✗ | 27/01/17 |
SrPb3 | COD | 1523436 | P4/mmm (123) | ✔ | 4 | 52 | 3 | 0.0 | 0.003 | 0.554 | (1;110) | ✗ | 27/01/17 |
Pb | ICSD | 648350 | P6_3/mmc (194) | ✔ | 2 | 28 | 3 | 0.0 | 0.003 | 0.725 | (1;000) | ✗ | 27/01/17 |
Pb | COD | 9012004 | Fm-3m (225) | ✔ | 1 | 14 | 3 | 0.0 | 1.012 | 0.559 | (0;000) | ✗ | 27/01/17 |
Pd3Pb | ICSD | 648357 | Pm-3m (221) | ✔ | 4 | 68 | 3 | 0.0 | 0.000 | 0.144 | (1;000) | ✗ | 27/01/17 |
Pt3Pb | COD | 1523554 | Pm-3m (221) | ✔ | 4 | 44 | 3 | 0.0 | 0.213 | 0.252 | (0;111) | ✗ | 27/01/17 |
SiPt5Pb | ICSD | 648402 | P4/mmm (123) | ✔ | 7 | 68 | 3 | 0.0 | 0.004 | 0.374 | (0;000) | ✗ | 27/01/17 |
PtPb | ICSD | 105602 | P6_3/mmc (194) | ✔ | 4 | 48 | 3 | 0.0 | 0.221 | 0.639 | (1;000) | ✗ | 27/01/17 |
PtPb | COD | 1522617 | P6_3/mmc (194) | ✔ | 4 | 48 | 3 | 0.0 | 0.032 | 0.702 | (0;000) | ✗ | 27/01/17 |
TaPbS2 | ICSD | 648482 | P6_3/mmc (194) | ✔ | 8 | 78 | 3 | 0.0 | 0.000 | 0.917 | (1;000) | ✗ | 27/01/17 |
PbSe2 | ICSD | 174577 | I4/mcm (140) | ✔ | 6 | 52 | 3 | 0.0 | 0.110 | 0.122 | (0;000) | ✗ | 27/01/17 |
PbSe | ICSD | 77870 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.384 | 0.336 | (1;111) | ✗ | 27/01/17 |
PbSe | COD | 9008695 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.2077 | 0.208 | 0.000 | (0;000) | ✗ | 27/01/17 |
PbS | ICSD | 648451 | Pnma (62) | ✔ | 8 | 80 | 3 | 1.2827 | 1.314 | 0.000 | (0;000) | ✗ | 27/01/17 |
PbS | COD | 9013400 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.0 | 0.122 | 0.020 | (0;000) | ✗ | 27/01/17 |
PbS | ICSD | 77865 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.271 | 0.306 | (1;111) | ✗ | 27/01/17 |
Co2B | ICSD | 30447 | I4/mcm (140) | ✔ | 6 | 42 | 3 | 0.0 | 0.000 | 0.495 | (1;111) | ✗ | 06/10/16 |
SiPd | ICSD | 41681 | I4/mcm (140) | ✔ | 8 | 88 | 3 | 0.0 | 0.021 | 0.300 | (1;000) | ✗ | 27/01/17 |
ZnGeP2 | ICSD | 16734 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.319 | 1.491 | 0.000 | (0;000) | ✗ | 07/10/16 |
TePb | ICSD | 77882 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.059 | 0.517 | (1;111) | ✗ | 27/01/17 |
TePb | COD | 9008696 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.1189 | 0.119 | 0.000 | (0;000) | ✗ | 27/01/17 |
V3Pb | COD | 1523836 | Pm-3n (223) | ✔ | 8 | 106 | 3 | 0.0 | 0.000 | 0.887 | (1;000) | ✗ | 27/01/17 |
Sr(SbPd)2 | ICSD | 61195 | I4/mmm (139) | ✔ | 5 | 56 | 3 | 0.0 | 0.008 | 0.775 | (0;000) | ✗ | 27/01/17 |
Sr(SiPd)2 | ICSD | 648864 | I4/mmm (139) | ✔ | 5 | 54 | 3 | 0.0 | 0.020 | 0.692 | (0;000) | ✗ | 27/01/17 |
SnPd2 | ICSD | 42595 | Pnma (62) | ✔ | 12 | 200 | 3 | 0.0 | 0.027 | 0.491 | (0;000) | ✗ | 27/01/17 |
SrPd2 | COD | 1523821 | Fd-3m (227) | ✔ | 6 | 92 | 3 | 0.0 | 0.000 | 0.310 | (0;000) | ✗ | 27/01/17 |
TiPd2 | ICSD | 184670 | I4/mmm (139) | ✔ | 3 | 48 | 3 | 0.0 | 0.005 | 0.210 | (1;111) | ✗ | 27/01/17 |
ZnPd2 | ICSD | 649139 | Pnma (62) | ✔ | 12 | 192 | 3 | 0.0 | 0.009 | 0.364 | (0;000) | ✗ | 27/01/17 |
ZrPd2 | ICSD | 649147 | I4/mmm (139) | ✔ | 3 | 40 | 3 | 0.0 | 0.033 | 0.184 | (1;111) | ✗ | 27/01/17 |
Tl2Pd3S2 | ICSD | 648763 | R-3m (166) | ✔ | 7 | 92 | 3 | 0.0 | 0.071 | 0.442 | (0;111) | ✗ | 27/01/17 |
Tl2Pd3Se2 | ICSD | 648843 | R-3m (166) | ✔ | 7 | 92 | 3 | 0.0 | 0.004 | 0.569 | (1;111) | ✗ | 27/01/17 |
Ta2PdSe6 | ICSD | 61005 | C2/m (12) | ✔ | 9 | 80 | 3 | 0.0 | 0.026 | 0.245 | (1;110) | ✗ | 27/01/17 |
SnPd3 | COD | 9004160 | Pm-3m (221) | ✔ | 4 | 68 | 3 | 0.0 | 0.000 | 0.202 | (1;000) | ✗ | 27/01/17 |
Te2Pd3 | ICSD | 87915 | Cmcm (63) | ✔ | 10 | 132 | 3 | 0.0 | 0.011 | 0.630 | (0;000) | ✗ | 27/01/17 |
TiPd3 | COD | 1522883 | Pm-3m (221) | ✔ | 4 | 66 | 3 | 0.0 | 0.000 | 0.376 | (1;111) | ✗ | 27/01/17 |