▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
HgCl | COD | 9016588 | I4/mmm (139) | ✔ | 4 | 38 | 3 | 1.4848 | 2.394 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2O2 | COD | 9008990 | Immm (71) | ✔ | 4 | 30 | 1 | 1.7779 | 1.859 | 0.000 | (0;000) | ✗ | 27/01/17 |
SnO | COD | 7206470 | P4/nmm (129) | ✔ | 4 | 40 | 2 | 0.1699 | 1.998 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsS | COD | 1529661 | Immm (71) | ✔ | 4 | 30 | 1 | 1.7649 | 1.976 | 0.000 | (0;000) | ✗ | 27/01/17 |
MoN | ICSD | 76280 | P6_3/mmc (194) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.939 | (0;000) | ✗ | 06/10/16 |
MgW | COD | 9015083 | Pmma (51) | ✔ | 4 | 48 | 1 | 0.0 | 0.094 | 0.191 | (0;000) | ✗ | 27/01/17 |
GaFe2Co | COD | 1524146 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.006 | 0.350 | (1;000) | ✗ | 27/01/17 |
Fe3Si | COD | 9015110 | Fm-3m (225) | ✔ | 4 | 28 | 3 | 0.0 | 0.000 | 0.618 | (0;000) | ✗ | 27/01/17 |
MoRh | ICSD | 108608 | Pmma (51) | ✔ | 4 | 62 | 3 | 0.0 | 0.000 | 0.802 | (0;001) | ✗ | 27/01/17 |
MnAlCo2 | ICSD | 606611 | Fm-3m (225) | ✔ | 4 | 52 | 3 | 0.0 | 0.007 | 0.260 | (0;000) | ✗ | 05/01/17 |
Li2InIr | ICSD | 639824 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.005 | 0.483 | (1;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 |
TeRh | COD | 9008916 | P6_3/mmc (194) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.849 | (0;000) | ✗ | 27/01/17 |
Sr3PbO | COD | 1525463 | Pm-3m (221) | ✔ | 5 | 50 | 1 | 0.024 | 0.024 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2CdPd2 | ICSD | 425471 | Immm (71) | ✔ | 5 | 68 | 3 | 0.0 | 0.029 | 0.632 | (0;111) | ✗ | 27/01/17 |
Ag3SI | ICSD | 93431 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4794 | 0.925 | 0.000 | (0;000) | ✔ | 06/10/16 |
Ag3SI | ICSD | 26450 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4408 | 1.001 | 0.000 | (0;000) | ✔ | 28/11/16 |
Ca2CdPt2 | ICSD | 424554 | Immm (71) | ✔ | 5 | 52 | 3 | 0.0 | 0.034 | 0.602 | (0;000) | ✗ | 27/01/17 |
Ag3SI | ICSD | 201005 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4545 | 1.022 | 0.000 | (0;000) | ✔ | 28/11/16 |
Ag3SI | ICSD | 174095 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4293 | 0.829 | 0.000 | (0;000) | ✔ | 06/10/16 |
BaGe3Pt | ICSD | 174262 | I4mm (107) | ✗ | 5 | 32 | 3 | 0.0 | 0.014 | 0.403 | (1;011) | ✔ | 07/10/16 |
Ag3SI | ICSD | 159858 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4293 | 0.829 | 0.000 | (0;000) | ✔ | 06/10/16 |
Na2TeC2 | COD | 7220793 | I4/mmm (139) | ✔ | 5 | 32 | 1 | 1.5257 | 1.827 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2PdC2 | COD | 1526412 | P-3m1 (164) | ✔ | 5 | 44 | 3 | 1.5508 | 1.551 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2PtC2 | COD | 1526414 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.9106 | 0.913 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba(AlGe)2 | COD | 1532740 | I4/mmm (139) | ✔ | 5 | 24 | 2 | 0.0 | 0.028 | 0.264 | (0;000) | ✗ | 05/01/17 |
BaGe3Pd | ICSD | 174261 | I4mm (107) | ✗ | 5 | 32 | 3 | 0.0 | 0.018 | 0.403 | (1;111) | ✔ | 07/10/16 |
Na2PtC2 | ICSD | 411389 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.0 | 0.122 | 0.052 | (0;000) | ✗ | 27/01/17 |
Y2O3 | ICSD | 192864 | P-3m1 (164) | ✔ | 5 | 40 | 3 | 3.7363 | 4.341 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2PdC2 | ICSD | 50172 | P-3m1 (164) | ✔ | 5 | 44 | 3 | 0.926 | 1.020 | 0.000 | (0;000) | ✗ | 27/01/17 |
AgNO3 | ICSD | 35157 | R3m (160) | ✗ | 5 | 34 | 3 | 2.0793 | 2.425 | 0.000 | (0;000) | ✗ | 06/10/16 |
K2PdC2 | ICSD | 421490 | P-3m1 (164) | ✔ | 5 | 44 | 3 | 1.4251 | 1.457 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2PtC2 | ICSD | 421491 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.7799 | 0.813 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li2TeC2 | COD | 7220792 | P-3m1 (164) | ✔ | 5 | 20 | 1 | 0.0 | 0.036 | 0.234 | (0;000) | ✗ | 27/01/17 |
SrZrO3 | COD | 1521389 | Pm-3m (221) | ✔ | 5 | 32 | 3 | 2.9809 | 2.981 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrRuO3 | ICSD | 162777 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 0.0 | 0.000 | 0.837 | (1;000) | ✗ | 27/01/17 |
Cs2PdC2 | COD | 1526416 | P-3m1 (164) | ✔ | 5 | 44 | 3 | 1.5635 | 1.637 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrSiO3 | ICSD | 248973 | Pm-3m (221) | ✔ | 5 | 32 | 3 | 4.9596 | 5.574 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mg(AlC)2 | COD | 4030910 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 1.602 | 2.609 | 0.000 | (0;000) | ✗ | 27/01/17 |
Cs2PtC2 | COD | 1526418 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.8218 | 0.869 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiPbO3 | COD | 9011193 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 1.6718 | 1.692 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrSnO3 | ICSD | 27047 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 1.766 | 2.562 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaSi3Pd | ICSD | 174266 | I4mm (107) | ✗ | 5 | 32 | 3 | 0.0 | 0.017 | 0.443 | (0;001) | ✔ | 07/10/16 |
Ba(AlSi)2 | ICSD | 153385 | I4/mmm (139) | ✔ | 5 | 24 | 2 | 0.0 | 0.000 | 0.319 | (1;000) | ✗ | 05/01/17 |
SrTiO3 | COD | 9006864 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 1.9101 | 2.241 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ti3TlN | ICSD | 42931 | Pm-3m (221) | ✔ | 5 | 54 | 3 | 0.0 | 0.004 | 0.212 | (0;111) | ✗ | 27/01/17 |
Ca2ZnN2 | COD | 1005002 | I4/mmm (139) | ✔ | 5 | 42 | 1 | 0.7565 | 0.981 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sc3SnB | COD | 1511324 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.112 | (1;000) | ✗ | 27/01/17 |
SrZrO3 | COD | 1010901 | Pm-3m (221) | ✔ | 5 | 32 | 3 | 0.0 | 0.007 | 0.627 | (0;000) | ✗ | 27/01/17 |
Rb3BrO | ICSD | 77196 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 0.4411 | 0.441 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sb2Te3 | ICSD | 2084 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.1121 | 0.227 | 0.000 | (1;000) | ✗ | 06/10/16 |
Sr(SnAs)2 | COD | 1008735 | R-3m (166) | ✔ | 5 | 48 | 2 | 0.0 | 0.091 | 0.028 | (1;000) | ✗ | 05/01/17 |
Li3BrO | ICSD | 67265 | Pm-3m (221) | ✔ | 5 | 22 | 1 | 4.0589 | 4.319 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaSn3Pd | ICSD | 58673 | I4mm (107) | ✗ | 5 | 62 | 3 | 0.0 | 0.011 | 0.382 | (0;110) | ✔ | 07/10/16 |
Sr(ZnAs)2 | ICSD | 23248 | P-3m1 (164) | ✔ | 5 | 44 | 2 | 0.2109 | 0.211 | 0.000 | (0;000) | ✗ | 05/01/17 |
K3BrO | ICSD | 33920 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 0.9272 | 0.927 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2NiO2 | ICSD | 66277 | I4/mmm (139) | ✔ | 5 | 40 | 1 | 0.0 | 0.051 | 0.639 | (0;000) | ✗ | 27/01/17 |
CsHgBr3 | COD | 1010118 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.000 | 0.157 | (1;000) | ✗ | 27/01/17 |
CsSnBr3 | ICSD | 4071 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 0.0133 | 0.013 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2CN2 | ICSD | 411094 | C2/m (12) | ✔ | 5 | 32 | 1 | 3.3274 | 3.327 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsCdBr3 | COD | 1010122 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.8231 | 1.294 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsCaBr3 | ICSD | 77242 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 4.484 | 4.646 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsGeBr3 | ICSD | 80320 | Pm-3m (221) | ✔ | 5 | 34 | 3 | 0.0 | 0.090 | 0.026 | (1;111) | ✗ | 27/01/17 |
Ni4W | COD | 1523560 | I4/m (87) | ✔ | 5 | 54 | 3 | 0.0 | 0.023 | 0.698 | (1;000) | ✗ | 27/01/17 |
Y2Ni2Sn | ICSD | 186294 | Immm (71) | ✔ | 5 | 56 | 3 | 0.0 | 0.024 | 0.399 | (0;111) | ✗ | 27/01/17 |
Zr(SiNi)2 | COD | 1530965 | I4/mmm (139) | ✔ | 5 | 32 | 3 | 0.0 | 0.007 | 0.543 | (0;000) | ✗ | 27/01/17 |
Hg(NCl)2 | COD | 9008060 | Cmmm (65) | ✔ | 5 | 36 | 2 | 0.0 | 0.000 | 0.623 | (0;001) | ✗ | 27/01/17 |
Te3As2 | ICSD | 68110 | R-3m (166) | ✔ | 5 | 28 | 2 | 0.0 | 0.077 | 0.045 | (1;000) | ✗ | 05/01/17 |
CsHgCl3 | COD | 1010121 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.397 | 0.385 | (0;000) | ✗ | 27/01/17 |
ZrBRh3 | ICSD | 615353 | Pm-3m (221) | ✔ | 5 | 58 | 3 | 0.0 | 0.000 | 0.110 | (0;111) | ✗ | 27/01/17 |
Sr(NiSb)2 | ICSD | 646442 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.009 | 0.764 | (0;000) | ✗ | 27/01/17 |
NaTaO3 | ICSD | 28617 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 2.2699 | 2.960 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sc3BPb | COD | 1511293 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.106 | (1;000) | ✗ | 27/01/17 |
Mn3InC | ICSD | 106306 | Pm-3m (221) | ✔ | 5 | 62 | 3 | 0.0 | 0.003 | 0.681 | (0;000) | ✗ | 27/01/17 |
NaNbO3 | COD | 1011064 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 1.7183 | 2.402 | 0.000 | (0;000) | ✗ | 27/01/17 |
TlIO3 | ICSD | 76967 | Pm-3m (221) | ✔ | 5 | 38 | 3 | 0.0 | 0.292 | 0.119 | (1;111) | ✗ | 30/01/17 |
Ta4O | ICSD | 76022 | Pmmm (47) | ✔ | 5 | 58 | 3 | 0.0 | 0.040 | 0.441 | (0;111) | ✗ | 27/01/17 |
TlIO3 | ICSD | 62106 | R3m (160) | ✗ | 5 | 38 | 1 | 2.5705 | 2.612 | 0.000 | (0;000) | ✗ | 06/10/16 |
RbIO3 | ICSD | 2825 | R3m (160) | ✗ | 5 | 34 | 1 | 2.7038 | 2.708 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ni3GeC | ICSD | 77001 | Pm-3m (221) | ✔ | 5 | 38 | 3 | 0.0 | 0.016 | 0.341 | (0;111) | ✗ | 27/01/17 |
Na2PtO2 | ICSD | 25018 | Immm (71) | ✔ | 5 | 40 | 1 | 1.5347 | 1.903 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ni4W | ICSD | 105452 | I4/m (87) | ✔ | 5 | 54 | 3 | 0.0 | 0.023 | 0.698 | (1;000) | ✗ | 06/10/16 |
Sc3GaC | ICSD | 50162 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.113 | (1;000) | ✗ | 27/01/17 |
KIO3 | ICSD | 97995 | R3m (160) | ✗ | 5 | 34 | 1 | 2.7686 | 2.769 | 0.000 | (0;000) | ✗ | 06/10/16 |
Mn3InC | ICSD | 657357 | Pm-3m (221) | ✔ | 5 | 62 | 3 | 0.0 | 0.000 | 0.358 | (1;000) | ✗ | 27/01/17 |
KIO3 | ICSD | 28545 | Pm-3m (221) | ✔ | 5 | 34 | 3 | 0.0 | 0.091 | 0.116 | (1;111) | ✗ | 30/01/17 |
NbAgO3 | ICSD | 55649 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 1.4258 | 1.496 | 0.000 | (0;000) | ✗ | 05/01/17 |
Y3GaC | ICSD | 56396 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.111 | (1;000) | ✗ | 27/01/17 |
Sr2ZnN2 | COD | 1005019 | I4/mmm (139) | ✔ | 5 | 42 | 1 | 0.6805 | 0.681 | 0.000 | (0;000) | ✗ | 27/01/17 |
Fe3SnC | ICSD | 76842 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.003 | 0.465 | (1;000) | ✗ | 27/01/17 |
ZnFe3C | ICSD | 76763 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 0.0 | 0.000 | 0.444 | (1;111) | ✗ | 27/01/17 |
Ni4Mo | COD | 1523776 | I4/m (87) | ✔ | 5 | 54 | 3 | 0.0 | 0.001 | 0.721 | (1;000) | ✗ | 27/01/17 |
SrMoO3 | ICSD | 174206 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.000 | 0.772 | (0;000) | ✗ | 27/01/17 |
Mn3GaC | COD | 1008110 | Pm-3m (221) | ✔ | 5 | 62 | 3 | 0.0 | 0.000 | 0.317 | (1;000) | ✗ | 27/01/17 |
Sc3InC | ICSD | 50163 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.108 | (1;000) | ✗ | 27/01/17 |
Mn2ZnAs2 | ICSD | 39512 | P-3m1 (164) | ✔ | 5 | 52 | 3 | 0.0 | 0.014 | 0.505 | (0;001) | ✗ | 05/01/17 |
SrMoO3 | ICSD | 174207 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.000 | 0.772 | (0;000) | ✗ | 27/01/17 |
Zr2SN2 | COD | 4124522 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 0.6062 | 1.069 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mn3PtN | COD | 1009046 | Pm-3m (221) | ✔ | 5 | 60 | 3 | 0.0 | 0.001 | 0.632 | (0;111) | ✗ | 27/01/17 |
Mn3ZnN | COD | 1009051 | Pm-3m (221) | ✔ | 5 | 62 | 3 | 0.0 | 0.000 | 0.450 | (1;000) | ✗ | 27/01/17 |