Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Na6S2ClO8F | COD | 1011182 | Fm-3m (225) | ✔ | 18 | 128 | 1 | 4.6318 | 4.636 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Pb2ClOF | COD | 9012904 | Cmme (67) | ✔ | 10 | 96 | 2 | 2.3301 | 2.444 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SnClF | ICSD | 647 | Pnma (62) | ✔ | 12 | 112 | 2 | 3.2601 | 3.299 | 0.000 | (0;000) | ✗ | 02/02/17 |
| GaTeCl | COD | 7221395 | Pnnm (58) | ✔ | 12 | 104 | 2 | 2.0533 | 2.053 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiH2ClO | COD | 2201759 | Cmcm (63) | ✔ | 20 | 72 | 1 | 5.5527 | 5.579 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Hg2ClO | COD | 2310659 | C2/c (15) | ✔ | 16 | 148 | 3 | 1.3653 | 1.404 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Hg2ClO | COD | 9009904 | C2/c (15) | ✔ | 16 | 148 | 3 | 1.8283 | 1.933 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Hg2P3Cl | ICSD | 74771 | C2/c (15) | ✔ | 12 | 92 | 3 | 1.102 | 1.651 | 0.000 | (0;000) | ✗ | 02/02/17 |
| HgSNCl | ICSD | 20269 | Pnma (62) | ✔ | 16 | 120 | 1 | 0.0 | 0.005 | 0.387 | (1;000) | ✗ | 02/02/17 |
| HPbClO | COD | 9008250 | Pnma (62) | ✔ | 16 | 112 | 1 | 3.0497 | 3.098 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ICl | ICSD | 23886 | P2_1/c (14) | ✔ | 16 | 112 | 1 | 1.283 | 1.441 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiCN | COD | 9008984 | Pnma (62) | ✔ | 12 | 48 | 1 | 5.7574 | 5.757 | 0.000 | (0;000) | ✗ | 02/02/17 |
| InSb2S4Cl | ICSD | 159468 | C2/m (12) | ✔ | 16 | 108 | 3 | 1.4761 | 1.484 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiCSN | ICSD | 425061 | Pnma (62) | ✔ | 16 | 72 | 1 | 3.7343 | 4.049 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ICl | COD | 9008992 | P2_1/c (14) | ✔ | 16 | 112 | 1 | 1.6268 | 1.696 | 0.000 | (0;000) | ✗ | 02/02/17 |
| PbICl | ICSD | 22137 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.9909 | 2.048 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SnICl | ICSD | 23262 | Pnma (62) | ✔ | 12 | 112 | 1 | 2.1913 | 2.256 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K3ClO | ICSD | 78891 | Pnma (62) | ✔ | 20 | 160 | 1 | 1.1192 | 1.119 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KMnCl | ICSD | 173938 | Imma (74) | ✔ | 6 | 62 | 1 | 0.0 | 0.001 | 0.755 | (1;101) | ✗ | 02/02/17 |
| KMoPClO5 | ICSD | 50988 | P4/nmm (129) | ✔ | 18 | 130 | 2 | 0.0 | 0.000 | 0.918 | (0;000) | ✗ | 02/02/17 |
| KClO3 | COD | 2310654 | Pnma (62) | ✔ | 20 | 136 | 1 | 3.1985 | 3.200 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiClO2 | COD | 2014617 | P4_2/ncm (138) | ✔ | 16 | 88 | 1 | 2.6354 | 2.635 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sr2MnClO3 | ICSD | 94745 | P4/nmm (129) | ✔ | 14 | 120 | 1 | 0.0 | 0.003 | 0.963 | (0;001) | ✗ | 02/02/17 |
| MnSbS2Cl | ICSD | 151925 | Pnma (62) | ✔ | 20 | 156 | 3 | 0.0 | 0.001 | 0.373 | (1;011) | ✗ | 02/02/17 |
| SeCl | ICSD | 37018 | P2_1/c (14) | ✔ | 16 | 104 | 1 | 2.1612 | 2.199 | 0.000 | (0;000) | ✗ | 02/02/17 |
| YMoClO4 | COD | 4304780 | C2/m (12) | ✔ | 14 | 112 | 3 | 2.7876 | 3.153 | 0.000 | (0;000) | ✗ | 02/02/17 |
| RbMoPClO5 | ICSD | 50989 | P4/nmm (129) | ✔ | 18 | 130 | 2 | 0.0 | 0.000 | 0.927 | (0;000) | ✗ | 02/02/17 |
| NaClO3 | COD | 1001127 | P2_1/c (14) | ✔ | 20 | 136 | 1 | 4.8842 | 4.976 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sr2NiClO3 | ICSD | 237581 | P4/nmm (129) | ✔ | 14 | 110 | 1 | 0.0 | 0.000 | 0.901 | (0;000) | ✗ | 02/02/17 |
| NClO6 | ICSD | 25817 | C2/c (15) | ✔ | 16 | 96 | 1 | 2.1258 | 2.155 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NCl | COD | 9014419 | Pa3 (205) | ✔ | 16 | 96 | 1 | 0.0 | 0.005 | 0.742 | (1;000) | ✗ | 02/02/17 |
| SNCl | ICSD | 30558 | P2_1/m (11) | ✔ | 18 | 108 | 1 | 2.4393 | 2.446 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ReClO3 | ICSD | 416751 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 3.6638 | 3.734 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sb3ClO4 | ICSD | 410039 | P2/c (13) | ✔ | 16 | 92 | 3 | 0.0 | 2.942 | 1.000 | (0;000) | ✗ | 02/02/17 |
| Cl2 | COD | 9015583 | P4_2/ncm (138) | ✔ | 16 | 112 | 1 | 0.2095 | 0.551 | 0.000 | (0;000) | ✗ | 02/02/17 |
| PbClO | COD | 9015232 | Pnma (62) | ✔ | 12 | 108 | 1 | 0.0 | 0.001 | 0.436 | (1;011) | ✗ | 02/02/17 |
| PbClO | COD | 9015322 | Pnma (62) | ✔ | 12 | 108 | 2 | 0.0 | 0.001 | 0.655 | (1;011) | ✗ | 02/02/17 |
| Re3Se4Cl | ICSD | 35623 | P-1 (2) | ✔ | 16 | 152 | 3 | 0.9776 | 1.114 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SrCN2 | ICSD | 75040 | Pnma (62) | ✔ | 16 | 96 | 1 | 3.7125 | 4.317 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Na2CS3 | ICSD | 73094 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.1499 | 1.499 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaC | COD | 1521140 | I4_1/acd (142) | ✔ | 16 | 104 | 1 | 3.5905 | 3.703 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaCSN | ICSD | 22273 | Pnma (62) | ✔ | 16 | 96 | 1 | 4.1244 | 4.235 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaCSN | ICSD | 953 | Pnma (62) | ✔ | 16 | 96 | 1 | 4.1824 | 4.311 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CN | COD | 2310460 | Pbca (61) | ✔ | 16 | 72 | 1 | 5.2499 | 5.250 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Co2CuS4 | COD | 1010946 | Fd-3m (227) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.789 | (0;000) | ✗ | 02/02/17 |
| Co2CuS4 | COD | 9009688 | Fd-3m (227) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.886 | (0;000) | ✗ | 02/02/17 |
| Sc3Co2Ge3 | COD | 1527681 | Cmcm (63) | ✔ | 16 | 158 | 3 | 0.0 | 0.000 | 0.899 | (1;000) | ✗ | 02/02/17 |
| NaCo2Mo2H3O10 | ICSD | 422475 | C2/m (12) | ✔ | 18 | 134 | 3 | 0.0 | 0.004 | 0.622 | (0;001) | ✗ | 02/02/17 |
| Hf3Co2Si3 | ICSD | 623796 | Cmcm (63) | ✔ | 16 | 164 | 3 | 0.0 | 0.007 | 0.913 | (0;000) | ✗ | 02/02/17 |
| KIn9Co2 | COD | 4301694 | P6/mmm (191) | ✔ | 12 | 160 | 3 | 0.0 | 0.003 | 0.823 | (0;001) | ✗ | 02/02/17 |
| RbNa7(CoO3)2 | ICSD | 66006 | C2/m (12) | ✔ | 16 | 142 | 1 | 0.0 | 0.013 | 0.132 | (0;001) | ✗ | 02/02/17 |
| NbCo2Sn | ICSD | 190616 | Pmma (51) | ✔ | 16 | 244 | 3 | 0.0 | 0.002 | 0.708 | (0;100) | ✗ | 02/02/17 |
| Co2NiS4 | ICSD | 624468 | Fd-3m (227) | ✔ | 14 | 136 | 3 | 0.0 | 0.030 | 0.439 | (0;000) | ✗ | 02/02/17 |
| RbCO2 | ICSD | 163587 | Pbam (55) | ✔ | 16 | 100 | 1 | 3.1932 | 3.193 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sc3Co2Si3 | ICSD | 41745 | Cmcm (63) | ✔ | 16 | 158 | 3 | 0.0 | 0.000 | 0.898 | (1;000) | ✗ | 02/02/17 |
| Zr3Co2Si3 | ICSD | 625141 | Cmcm (63) | ✔ | 16 | 116 | 3 | 0.0 | 0.010 | 0.916 | (0;000) | ✗ | 02/02/17 |
| TlCO2 | COD | 4308986 | P2_1/c (14) | ✔ | 16 | 116 | 2 | 2.5146 | 2.589 | 0.000 | (0;000) | ✗ | 02/02/17 |
| YGa2Co3 | COD | 1524384 | P6/mmm (191) | ✔ | 18 | 264 | 3 | 0.0 | 0.000 | 0.925 | (0;000) | ✗ | 02/02/17 |
| Y3GaCo3 | COD | 1525482 | Cmcm (63) | ✔ | 14 | 194 | 3 | 0.0 | 0.000 | 0.884 | (0;000) | ✗ | 02/02/17 |
| Y2Co3Ge5 | ICSD | 623668 | C2/c (15) | ✔ | 20 | 186 | 3 | 0.0 | 0.000 | 0.574 | (0;101) | ✗ | 02/02/17 |
| PbCO3 | COD | 9008411 | Pnma (62) | ✔ | 20 | 144 | 3 | 3.204 | 3.213 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb2Co3S4 | ICSD | 624797 | Ibam (72) | ✔ | 18 | 186 | 2 | 0.0 | 0.000 | 0.976 | (1;111) | ✗ | 02/02/17 |
| Co3S4 | COD | 1011056 | Fd-3m (227) | ✔ | 14 | 150 | 3 | 0.0 | 0.000 | 0.360 | (0;000) | ✗ | 02/02/17 |
| Co3Se4 | ICSD | 42538 | Fd-3m (227) | ✔ | 14 | 150 | 3 | 0.0 | 0.000 | 0.329 | (0;000) | ✗ | 02/02/17 |
| Y2Co3Si5 | ICSD | 60757 | Ibam (72) | ✔ | 20 | 186 | 3 | 0.0 | 0.001 | 0.662 | (0;000) | ✗ | 02/02/17 |
| Co3Sn2 | ICSD | 625259 | Pnma (62) | ✔ | 20 | 316 | 3 | 0.0 | 0.000 | 0.520 | (1;011) | ✗ | 02/02/17 |
| SrCO3 | COD | 9008198 | Pnma (62) | ✔ | 20 | 128 | 1 | 4.4705 | 4.482 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Co4SnSb12 | ICSD | 87886 | Im3 (204) | ✔ | 17 | 142 | 3 | 0.0 | 0.000 | 0.669 | (1;000) | ✗ | 02/02/17 |
| Fe(CoS)8 | ICSD | 622969 | Fm-3m (225) | ✔ | 17 | 192 | 3 | 0.0 | 0.000 | 0.689 | (1;000) | ✗ | 02/02/17 |
| Co8NiS8 | ICSD | 624466 | Fm-3m (225) | ✔ | 17 | 194 | 3 | 0.0 | 0.000 | 0.982 | (1;000) | ✗ | 02/02/17 |
| Co8PdS8 | ICSD | 624682 | Fm-3m (225) | ✔ | 17 | 202 | 3 | 0.0 | 0.000 | 0.982 | (1;000) | ✗ | 02/02/17 |
| Co8RuS8 | ICSD | 624822 | Fm-3m (225) | ✔ | 17 | 200 | 3 | 0.0 | 0.017 | 0.699 | (1;000) | ✗ | 02/02/17 |
| Cr2CoS4 | COD | 9012046 | Fd-3m (227) | ✔ | 14 | 138 | 3 | 0.0 | 0.001 | 0.420 | (0;000) | ✗ | 02/02/17 |
| Cs2NaCoF6 | ICSD | 42157 | R-3m (166) | ✔ | 20 | 172 | 2 | 0.666 | 0.668 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cs2CoS2 | ICSD | 67389 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.000 | 0.195 | (0;000) | ✗ | 02/02/17 |
| Cs2CoSe2 | ICSD | 67392 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.000 | 0.185 | (0;000) | ✗ | 02/02/17 |
| CsCoO2 | ICSD | 424937 | Cmce (64) | ✔ | 16 | 152 | 3 | 0.0 | 0.008 | 0.657 | (0;110) | ✗ | 02/02/17 |
| NaCoF3 | ICSD | 4404 | Pnma (62) | ✔ | 20 | 188 | 3 | 0.0 | 0.000 | 0.497 | (0;110) | ✗ | 02/02/17 |
| Ga3Co | COD | 1525237 | P4_2/mnm (136) | ✔ | 16 | 224 | 3 | 0.0 | 0.005 | 0.289 | (1;000) | ✗ | 02/02/17 |
| YGaCo | ICSD | 623231 | Pnma (62) | ✔ | 12 | 164 | 3 | 0.0 | 0.000 | 0.715 | (1;011) | ✗ | 02/02/17 |
| CoGeO3 | ICSD | 26814 | C2/c (15) | ✔ | 20 | 156 | 3 | 0.0 | 0.005 | 0.333 | (1;000) | ✗ | 02/02/17 |
| YCoGe | ICSD | 601866 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.005 | 0.570 | (1;000) | ✗ | 02/02/17 |
| Hf4CoP | ICSD | 623784 | P4/mcc (124) | ✔ | 12 | 140 | 3 | 0.0 | 0.004 | 0.353 | (0;110) | ✗ | 02/02/17 |
| ZnCoPHO5 | ICSD | 416823 | P-1 (2) | ✔ | 18 | 130 | 3 | 0.0 | 0.018 | 0.624 | (0;001) | ✗ | 02/02/17 |
| Co(IN2)3 | COD | 9015112 | Fm-3m (225) | ✔ | 10 | 68 | 1 | 0.0 | 0.033 | 0.289 | (1;000) | ✗ | 02/02/17 |
| Rb2CoI4 | COD | 1525243 | P2_1/m (11) | ✔ | 14 | 126 | 1 | 0.0 | 0.000 | 0.615 | (0;011) | ✗ | 02/02/17 |
| In2Co | COD | 2106591 | Fddd (70) | ✔ | 12 | 172 | 3 | 0.0 | 0.003 | 0.526 | (1;111) | ✗ | 02/02/17 |
| In2CoS4 | ICSD | 623937 | Fd-3m (227) | ✔ | 14 | 134 | 3 | 0.0 | 0.000 | 0.883 | (0;000) | ✗ | 02/02/17 |
| In2CoSe4 | ICSD | 658918 | Fd-3m (227) | ✔ | 14 | 134 | 3 | 0.0 | 0.000 | 0.762 | (0;000) | ✗ | 02/02/17 |
| In3Co | COD | 1524662 | P4_2/mnm (136) | ✔ | 16 | 224 | 3 | 0.0 | 0.011 | 0.342 | (0;000) | ✗ | 02/02/17 |
| K2CoO2 | ICSD | 74940 | P2_1/c (14) | ✔ | 20 | 188 | 1 | 0.0211 | 0.033 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K2CoS2 | ICSD | 67387 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.002 | 0.162 | (0;000) | ✗ | 02/02/17 |
| K2CoSe2 | ICSD | 67390 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.001 | 0.278 | (0;000) | ✗ | 02/02/17 |
| Sr2LiCoN2 | ICSD | 72387 | P4_2/mnm (136) | ✔ | 12 | 100 | 1 | 0.0 | 0.008 | 0.377 | (1;000) | ✗ | 02/02/17 |
| Y2MnCoO6 | ICSD | 188982 | P2_1/c (14) | ✔ | 20 | 180 | 3 | 0.0 | 0.028 | 0.093 | (0;000) | ✗ | 02/02/17 |
| CoTeMo | COD | 1521136 | Pmmn (59) | ✔ | 6 | 74 | 1 | 0.0 | 0.000 | 0.828 | (0;000) | ✗ | 02/02/17 |
| Na2CoS2 | ICSD | 67386 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.001 | 0.349 | (0;000) | ✗ | 02/02/17 |
| Na2CoSe2 | ICSD | 624264 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.003 | 0.333 | (0;000) | ✗ | 02/02/17 |
| NbCoTe2 | COD | 1005003 | Cmce (64) | ✔ | 16 | 168 | 2 | 0.0 | 0.004 | 0.563 | (0;000) | ✗ | 02/02/17 |
| CoSeO3 | ICSD | 155489 | Pnma (62) | ✔ | 20 | 164 | 3 | 0.0 | 0.000 | 0.663 | (0;110) | ✗ | 02/02/17 |