▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
SiO2 | ICSD | 153886 | P4_12_12 (92) | ✗ | 12 | 64 | 3 | 5.6311 | 5.636 | 0.000 | (0;000) | ✗ | 06/10/16 |
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 |
Hg4Pt | ICSD | 639148 | Im-3m (229) | ✔ | 5 | 58 | 3 | 0.0 | 0.659 | 0.309 | (0;000) | ✗ | 27/01/17 |
PbCO3 | COD | 9008411 | Pnma (62) | ✔ | 20 | 144 | 3 | 3.204 | 3.213 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaRh2 | ICSD | 108149 | Fd-3m (227) | ✔ | 6 | 88 | 3 | 0.0 | 0.007 | 0.591 | (0;000) | ✗ | 05/01/17 |
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 |
BaS2 | ICSD | 42134 | C2/c (15) | ✔ | 6 | 44 | 1 | 1.5646 | 1.599 | 0.000 | (0;000) | ✗ | 05/01/17 |
SrCO3 | COD | 9008198 | Pnma (62) | ✔ | 20 | 128 | 1 | 4.4705 | 4.482 | 0.000 | (0;000) | ✗ | 02/02/17 |
YRh | ICSD | 650541 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.056 | 0.331 | (0;000) | ✗ | 27/01/17 |
PNF2 | ICSD | 9684 | Cmc2_1 (36) | ✗ | 8 | 48 | 1 | 6.3002 | 6.301 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaSe2 | COD | 7221479 | C2/c (15) | ✔ | 6 | 44 | 1 | 1.009 | 1.076 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaSe | ICSD | 52695 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 0.8463 | 0.846 | 0.000 | (0;000) | ✗ | 05/01/17 |
InI | ICSD | 38129 | Ccmm (63) | ✔ | 4 | 40 | 3 | 1.1696 | 1.170 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sn2IF3 | ICSD | 2419 | C222_1 (20) | ✗ | 12 | 112 | 1 | 2.2326 | 2.389 | 0.000 | (0;000) | ✗ | 06/10/16 |
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 |
BaSe | COD | 9008601 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 1.7784 | 1.971 | 0.000 | (0;000) | ✗ | 05/01/17 |
NaMgF3 | ICSD | 156158 | Cmc2_1 (36) | ✗ | 10 | 80 | 3 | 9.1855 | 9.189 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ge3As4 | ICSD | 163833 | P-42m (111) | ✗ | 7 | 32 | 3 | 0.138 | 0.212 | 0.000 | (0;000) | ✔ | 06/10/16 |
InI | ICSD | 55181 | Cmcm (63) | ✔ | 4 | 40 | 3 | 0.7644 | 0.832 | 0.000 | (0;000) | ✗ | 06/10/16 |
K2HfF6 | ICSD | 47246 | P-62m (189) | ✗ | 9 | 72 | 1 | 5.3771 | 5.412 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaZnSi | COD | 1527803 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.001 | 0.295 | (0;000) | ✗ | 05/01/17 |
AlN | COD | 1523095 | Fm-3m (225) | ✔ | 2 | 8 | 3 | 5.1878 | 6.629 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaS | COD | 9008600 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 2.0979 | 2.188 | 0.000 | (0;000) | ✗ | 05/01/17 |
Si3As4 | ICSD | 163832 | P-42m (111) | ✗ | 7 | 32 | 3 | 0.3934 | 0.501 | 0.000 | (0;000) | ✔ | 06/10/16 |
TlI | ICSD | 26761 | Ccmm (63) | ✔ | 4 | 40 | 2 | 1.4715 | 1.656 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTe | ICSD | 616162 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 0.4495 | 0.532 | 0.000 | (0;000) | ✗ | 05/01/17 |
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 |
BaTe | COD | 9008602 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 1.2448 | 1.616 | 0.000 | (0;000) | ✗ | 05/01/17 |
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 |
SiO2 | ICSD | 154289 | P3_121 (152) | ✗ | 9 | 48 | 3 | 5.9953 | 6.285 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTl2 | ICSD | 58681 | P6_3/mmc (194) | ✔ | 6 | 72 | 3 | 0.0 | 0.027 | 0.062 | (0;000) | ✗ | 05/01/17 |
TiCl2 | COD | 9009121 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.0 | 0.003 | 0.554 | (0;000) | ✗ | 27/01/17 |
YCoO3 | ICSD | 155835 | Pnma (62) | ✔ | 20 | 184 | 3 | 0.2653 | 0.266 | 0.000 | (0;000) | ✗ | 02/02/17 |