▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Y2Zn17 | COD | 1522899 | R-3m (166) | ✔ | 19 | 226 | 3 | 0.0 | 0.000 | 0.513 | (1;000) | ✗ | 02/02/17 |
K2MgCr2(H2O5)2 | ICSD | 96781 | P-1 (2) | ✔ | 19 | 120 | 2 | 2.9615 | 2.991 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr6Li2Cr2N8O | ICSD | 411983 | P-1 (2) | ✔ | 19 | 140 | 1 | 1.7419 | 1.768 | 0.000 | (0;000) | ✗ | 02/02/17 |
KYH4C4O9 | ICSD | 109947 | P1 (1) | ✗ | 19 | 94 | 3 | 0.0 | 0.025 | 0.247 | (0;000) | ✔ | 21/03/17 |
Ca(Ni2B)6 | COD | 8103487 | R-3m (166) | ✔ | 19 | 148 | 3 | 0.0 | 0.003 | 0.766 | (1;111) | ✗ | 05/01/17 |
Sr(Ni2B)6 | COD | 8103490 | R-3m (166) | ✔ | 19 | 148 | 3 | 0.0 | 0.001 | 0.724 | (0;000) | ✗ | 05/01/17 |
Na2ZnH4(SeO5)2 | ICSD | 98685 | P-1 (2) | ✔ | 19 | 106 | 2 | 3.678 | 3.780 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2MgMo2(H2O5)2 | ICSD | 96782 | P-1 (2) | ✔ | 19 | 120 | 2 | 0.0 | 0.002 | 0.262 | (1;000) | ✗ | 02/02/17 |
Na2NiH4(SeO5)2 | ICSD | 98684 | P-1 (2) | ✔ | 19 | 104 | 2 | 0.0 | 0.009 | 0.013 | (0;000) | ✗ | 02/02/17 |
K2Cr2Cd(H2O5)2 | ICSD | 162408 | P-1 (2) | ✔ | 19 | 122 | 2 | 2.7697 | 2.951 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSb6(S2I)4 | ICSD | 27733 | P-1 (2) | ✔ | 19 | 118 | 1 | 1.4312 | 1.431 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb4Co2PdSe12 | ICSD | 41026 | C2/m (12) | ✔ | 19 | 176 | 3 | 0.0 | 0.005 | 0.031 | (1;001) | ✗ | 22/03/17 |
Ta4Co2PdSe12 | ICSD | 73319 | C2/m (12) | ✔ | 19 | 176 | 3 | 0.0 | 0.036 | 0.130 | (0;000) | ✗ | 22/03/17 |
Hf2Be17 | ICSD | 616280 | R-3m (166) | ✔ | 19 | 92 | 1 | 0.0 | 0.008 | 0.511 | (1;000) | ✗ | 05/01/17 |
Be17Nb2 | ICSD | 58724 | R-3m (166) | ✔ | 19 | 94 | 1 | 0.0 | 0.033 | 0.637 | (1;000) | ✗ | 05/01/17 |
Ta2Be17 | ICSD | 616430 | R-3m (166) | ✔ | 19 | 94 | 1 | 0.0 | 0.075 | 0.627 | (1;000) | ✗ | 05/01/17 |
Ti2Be17 | ICSD | 109217 | R-3m (166) | ✔ | 19 | 92 | 1 | 0.0 | 0.000 | 0.521 | (1;000) | ✗ | 05/01/17 |
Zr2Be17 | ICSD | 616514 | R-3m (166) | ✔ | 19 | 76 | 1 | 0.0 | 0.001 | 0.511 | (1;000) | ✗ | 05/01/17 |
Zr6CI12 | ICSD | 60918 | R-3 (148) | ✔ | 19 | 112 | 3 | 0.2079 | 0.289 | 0.000 | (0;000) | ✗ | 02/02/17 |
In6WO12 | COD | 1001180 | R-3 (148) | ✔ | 19 | 164 | 3 | 2.2144 | 2.226 | 0.000 | (0;000) | ✗ | 02/02/17 |
In6TeO12 | ICSD | 245526 | R-3 (148) | ✔ | 19 | 156 | 3 | 1.442 | 1.525 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca2MgP2(H2O5)2 | ICSD | 156224 | P-1 (2) | ✔ | 19 | 104 | 2 | 5.6684 | 5.802 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2Sc2B4O11 | ICSD | 86435 | P-1 (2) | ✔ | 19 | 120 | 3 | 4.5568 | 4.606 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y2Ga2Fe15 | ICSD | 631854 | R-3m (166) | ✔ | 19 | 168 | 3 | 3.9297 | 0.021 | 1.000 | (0;000) | ✗ | 22/03/17 |
Y2Fe17 | ICSD | 634081 | R-3m (166) | ✔ | 19 | 158 | 3 | 0.1004 | 0.023 | 1.000 | (0;000) | ✗ | 22/03/17 |
Ba(Ni2B)6 | COD | 8103483 | R-3m (166) | ✔ | 19 | 148 | 3 | 0.0 | 0.000 | 0.748 | (1;111) | ✗ | 02/02/17 |
Ba2Mg17 | ICSD | 150735 | R-3m (166) | ✔ | 19 | 190 | 1 | 0.0 | 0.012 | 0.675 | (0;000) | ✗ | 02/02/17 |
Na2Ni3P2(HO5)2 | ICSD | 425698 | C2/m (12) | ✔ | 19 | 120 | 2 | 0.0 | 0.016 | 0.199 | (0;000) | ✗ | 28/03/17 |
Y6WO12 | COD | 1525900 | R-3 (148) | ✔ | 19 | 152 | 3 | 2.6184 | 2.679 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y6TeO12 | ICSD | 247820 | R-3 (148) | ✔ | 19 | 144 | 3 | 3.0556 | 3.192 | 0.000 | (0;000) | ✗ | 02/02/17 |
Tl6TeO12 | ICSD | 37134 | R-3 (148) | ✔ | 19 | 156 | 3 | 0.0769 | 0.010 | 1.000 | (1;000) | ✗ | 02/02/17 |
K2Sr(PO3)4 | COD | 1007253 | I-4 (82) | ✗ | 19 | 120 | 1 | 5.7815 | 5.822 | 0.000 | (0;000) | ✗ | 29/03/17 |
Sc6WO12 | COD | 4001209 | R-3 (148) | ✔ | 19 | 152 | 3 | 2.3576 | 2.422 | 0.000 | (0;000) | ✗ | 02/02/17 |
Hf(FeSi)2 | ICSD | 20933 | Pbcm (57) | ✔ | 20 | 144 | 3 | 0.0 | 0.002 | 0.275 | (1;001) | ✗ | 02/02/17 |
BaPd(SeO3)2 | ICSD | 423571 | C2/c (15) | ✔ | 20 | 152 | 1 | 1.5909 | 1.856 | 0.000 | (0;000) | ✗ | 02/02/17 |
PPbSe3 | ICSD | 62230 | P2_1/c (14) | ✔ | 20 | 148 | 3 | 1.4514 | 1.517 | 0.000 | (0;000) | ✗ | 02/02/17 |
Te6RhBr3 | ICSD | 423669 | R-3c (167) | ✔ | 20 | 148 | 3 | 0.7889 | 0.927 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Li3GaO4 | ICSD | 69491 | Ibam (72) | ✔ | 20 | 128 | 2 | 4.0292 | 4.029 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiBO3 | COD | 7209481 | P2_1/c (14) | ✔ | 20 | 144 | 3 | 2.9857 | 2.986 | 0.000 | (0;000) | ✗ | 02/02/17 |
YCoO3 | ICSD | 155835 | Pnma (62) | ✔ | 20 | 184 | 3 | 0.2653 | 0.266 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cr2Te3 | COD | 1527084 | P-31c (163) | ✔ | 20 | 184 | 3 | 0.0 | 0.004 | 0.226 | (0;000) | ✗ | 02/02/17 |
Sr2CoWO6 | ICSD | 97662 | P2_1/c (14) | ✔ | 20 | 174 | 3 | 0.0 | 0.000 | 0.979 | (0;010) | ✗ | 02/02/17 |
YScO3 | ICSD | 237285 | Pnma (62) | ✔ | 20 | 160 | 3 | 4.5155 | 4.516 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrSnS3 | ICSD | 651032 | Pnma (62) | ✔ | 20 | 168 | 2 | 1.0794 | 1.289 | 0.000 | (0;000) | ✗ | 02/02/17 |
Pb(SN)2 | ICSD | 49539 | P2_12_12_1 (19) | ✗ | 20 | 144 | 1 | 1.3435 | 1.403 | 0.000 | (0;000) | ✗ | 29/03/17 |
NaSb(PS3)2 | ICSD | 155270 | P2_1 (4) | ✗ | 20 | 120 | 2 | 1.9131 | 2.022 | 0.000 | (0;000) | ✗ | 29/03/17 |
GeBr4 | COD | 8102926 | P2_1/c (14) | ✔ | 20 | 128 | 1 | 3.0218 | 3.068 | 0.000 | (0;000) | ✗ | 02/02/17 |
SiBr4 | COD | 2105707 | P2_1/c (14) | ✔ | 20 | 128 | 1 | 4.2129 | 4.288 | 0.000 | (0;000) | ✗ | 02/02/17 |
SnBr4 | ICSD | 51570 | P2_1/c (14) | ✔ | 20 | 168 | 1 | 2.8007 | 2.801 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaNbO3 | COD | 1528864 | Pmc2_1 (26) | ✗ | 20 | 160 | 3 | 2.3551 | 2.359 | 0.000 | (0;000) | ✗ | 29/03/17 |
VS4 | ICSD | 16797 | C2/c (15) | ✔ | 20 | 148 | 2 | 0.6894 | 0.769 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3Hg2 | COD | 2209338 | P4_2/mnm (136) | ✔ | 20 | 204 | 3 | 0.0 | 0.002 | 0.510 | (0;000) | ✗ | 02/02/17 |
Cs6GaSb3 | ICSD | 300216 | P2_1/m (11) | ✔ | 20 | 164 | 1 | 0.7326 | 0.805 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb3SnS6 | ICSD | 83038 | P6_322 (182) | ✗ | 20 | 178 | 3 | 0.0 | 0.000 | 0.986 | ? | ✗ | 29/03/17 |
Nb3NiS6 | COD | 9011967 | P6_322 (182) | ✗ | 20 | 170 | 3 | 0.0 | 0.000 | 0.815 | ? | ✗ | 29/03/17 |
PPbS3 | ICSD | 647906 | P2_1/c (14) | ✔ | 20 | 148 | 3 | 1.9505 | 1.962 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb3SnS6 | ICSD | 74695 | P6_322 (182) | ✗ | 20 | 178 | 3 | 0.0 | 0.000 | 0.972 | ? | ✗ | 29/03/17 |
Nb3NiSe6 | ICSD | 645098 | P6_322 (182) | ✗ | 20 | 170 | 3 | 0.0 | 0.000 | 0.856 | ? | ✗ | 29/03/17 |
BaRhO3 | COD | 1527219 | P6_3/mmc (194) | ✔ | 20 | 180 | 3 | 0.0 | 0.002 | 0.877 | (1;000) | ✗ | 02/02/17 |
CsSnF3 | ICSD | 236903 | P2_1/c (14) | ✔ | 20 | 176 | 1 | 3.7279 | 3.733 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ti(NbSe2)3 | ICSD | 645394 | P6_322 (182) | ✗ | 20 | 174 | 3 | 0.0 | 0.001 | 0.699 | ? | ✗ | 29/03/17 |
CsSO2F | ICSD | 93076 | Pnma (62) | ✔ | 20 | 136 | 1 | 4.8904 | 4.899 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaRuO3 | ICSD | 84652 | P6_3/mmc (194) | ✔ | 20 | 176 | 3 | 0.0 | 0.006 | 0.695 | (0;000) | ✗ | 02/02/17 |
Nb3Sb2Te5 | ICSD | 417101 | I-43m (217) | ✗ | 20 | 158 | 3 | 0.7725 | 0.972 | 0.000 | (0;000) | ✗ | 29/03/17 |
Ti(NbS2)3 | ICSD | 645331 | P6_322 (182) | ✗ | 20 | 174 | 3 | 0.0 | 0.001 | 0.647 | ? | ✗ | 29/03/17 |
CsHIF7 | ICSD | 71581 | P-1 (2) | ✔ | 20 | 132 | 1 | 4.706 | 4.783 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsReF8 | ICSD | 410829 | P4/nmm (129) | ✔ | 20 | 160 | 1 | 2.0109 | 2.046 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsSb2F7 | COD | 4343796 | C2/c (15) | ✔ | 20 | 136 | 1 | 4.3589 | 4.409 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb3VSe6 | ICSD | 645400 | P6_322 (182) | ✗ | 20 | 176 | 3 | 0.0 | 0.001 | 0.427 | ? | ✗ | 29/03/17 |
CsGaS3 | ICSD | 281723 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 2.6307 | 2.708 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsGaSe3 | COD | 1533091 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 1.9338 | 2.031 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cu4Pd | COD | 1524399 | P4_2/m (84) | ✔ | 20 | 248 | 3 | 0.0 | 0.013 | 0.640 | (0;000) | ✗ | 02/02/17 |
Nb2Tl5S4Br9 | ICSD | 418796 | Immm (71) | ✔ | 20 | 178 | 2 | 1.627 | 1.638 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaZrS3 | ICSD | 616104 | Pnma (62) | ✔ | 20 | 128 | 3 | 0.796 | 0.796 | 0.000 | (0;000) | ✗ | 02/02/17 |
CoTeO3 | ICSD | 500 | Pnma (62) | ✔ | 20 | 164 | 3 | 0.0 | 0.000 | 0.568 | (0;110) | ✗ | 02/02/17 |
RbB(CN)4 | COD | 4308589 | I4_1/a (88) | ✔ | 20 | 96 | 1 | 6.58 | 6.604 | 0.000 | (0;000) | ✗ | 02/02/17 |
SnPS3 | ICSD | 72835 | P2_1/c (14) | ✔ | 20 | 148 | 3 | 1.6984 | 1.832 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsI4 | ICSD | 44621 | P2_1/c (14) | ✔ | 20 | 148 | 1 | 1.4286 | 1.453 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3ScBr6 | ICSD | 401335 | P-31c (163) | ✔ | 20 | 160 | 1 | 3.3129 | 3.319 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3YBr6 | ICSD | 82355 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 4.1906 | 4.214 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrSnO3 | COD | 1521093 | Pnma (62) | ✔ | 20 | 168 | 3 | 2.1483 | 2.168 | 0.000 | (0;000) | ✗ | 02/02/17 |
Zr9Ni11 | COD | 1523714 | I4/m (87) | ✔ | 20 | 146 | 3 | 0.0 | 0.002 | 0.507 | (0;111) | ✗ | 29/03/17 |
TePbO3 | ICSD | 61343 | P4_1 (76) | ✗ | 20 | 152 | 3 | 2.5754 | 2.799 | 0.000 | (0;000) | ✗ | 29/03/17 |
HgBrO3 | ICSD | 31925 | C2/c (15) | ✔ | 20 | 148 | 2 | 3.4599 | 3.523 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaPS3 | ICSD | 412764 | P2_1/c (14) | ✔ | 20 | 132 | 1 | 3.1945 | 3.195 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba(AgTe)2 | ICSD | 246048 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.5488 | 0.549 | 0.000 | (0;000) | ✗ | 16/03/17 |
SnPSe3 | ICSD | 655564 | P2_1/c (14) | ✔ | 20 | 148 | 3 | 1.3154 | 1.357 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrPS3 | ICSD | 405191 | P2_1/c (14) | ✔ | 20 | 132 | 1 | 3.1418 | 3.142 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs4CdNi3F12 | COD | 1008268 | R-3m (166) | ✔ | 20 | 162 | 3 | 0.0 | 0.009 | 0.207 | (1;111) | ✗ | 22/03/17 |
Rb2SnO2 | ICSD | 24805 | P2_12_12_1 (19) | ✗ | 20 | 176 | 1 | 2.1572 | 2.226 | 0.000 | (0;000) | ✗ | 29/03/17 |
BaPSe3 | ICSD | 412768 | P2_1/c (14) | ✔ | 20 | 132 | 1 | 2.2266 | 2.278 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba(SiRh)2 | ICSD | 50158 | P2_1/c (14) | ✔ | 20 | 208 | 3 | 0.0 | 0.014 | 0.425 | (1;001) | ✗ | 02/02/17 |
Cs5Nb2S4Br9 | ICSD | 410590 | Immm (71) | ✔ | 20 | 158 | 1 | 1.7015 | 1.702 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sc2C3 | ICSD | 77396 | I-43d (220) | ✗ | 20 | 136 | 3 | 0.0 | 0.005 | 0.276 | (0;000) | ✔ | 15/03/17 |
Ag2HgO2 | COD | 7109248 | P4_32_12 (96) | ✗ | 20 | 184 | 3 | 0.581 | 0.581 | 0.000 | (0;000) | ✗ | 16/03/17 |
BaSnS3 | ICSD | 616071 | Pnma (62) | ✔ | 20 | 168 | 2 | 0.9252 | 1.180 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsPSO2 | ICSD | 20543 | P-1 (2) | ✔ | 20 | 128 | 1 | 4.3524 | 4.352 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsVO3 | COD | 1527493 | Pbcm (57) | ✔ | 20 | 160 | 2 | 3.1543 | 3.166 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaTeS3 | ICSD | 8 | Pnma (62) | ✔ | 20 | 136 | 1 | 1.8106 | 2.025 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ti2O3 | ICSD | 187466 | Pnma (62) | ✔ | 20 | 168 | 3 | 0.1059 | 0.171 | 0.000 | (0;000) | ✗ | 29/03/17 |