▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Zr2InCu2 | ICSD | 130034 | P4/mbm (127) | ✔ | 10 | 86 | 3 | 0.0 | 0.000 | 0.990 | (1;110) | ✗ | 02/02/17 |
Rb2MnS2 | ICSD | 65454 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.274 | (1;001) | ✗ | 02/02/17 |
MgPS3 | ICSD | 642729 | C2/m (12) | ✔ | 10 | 66 | 2 | 2.4505 | 2.456 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2P2Pd | COD | 7221367 | Cmcm (63) | ✔ | 10 | 92 | 2 | 0.4933 | 0.567 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2MnSe2 | ICSD | 65457 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.280 | (0;100) | ✗ | 02/02/17 |
TlSbO3 | ICSD | 77329 | R-3 (148) | ✔ | 10 | 72 | 3 | 0.8714 | 0.960 | 0.000 | (0;000) | ✗ | 29/03/17 |
W2N3 | ICSD | 186207 | P6_3/mmc (194) | ✔ | 10 | 142 | 2 | 0.0 | 0.000 | 0.768 | (0;000) | ✗ | 04/08/17 |
Rb2In3 | ICSD | 370026 | I4/mmm (139) | ✔ | 10 | 114 | 2 | 0.0406 | 0.042 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2MnSe2 | ICSD | 65456 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.274 | (0;100) | ✗ | 02/02/17 |
Sn3Pt2 | COD | 1522860 | P6_3/mmc (194) | ✔ | 10 | 124 | 3 | 0.0 | 0.022 | 0.721 | (1;000) | ✗ | 02/02/17 |
HgPS3 | ICSD | 2564 | P-1 (2) | ✔ | 10 | 70 | 2 | 1.7638 | 1.890 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr(CuSb)2 | ICSD | 41923 | P4/nmm (129) | ✔ | 10 | 84 | 3 | 0.0 | 0.004 | 0.483 | (0;001) | ✗ | 02/02/17 |
CsVI3 | ICSD | 26453 | P6_3/mmc (194) | ✔ | 10 | 86 | 1 | 0.0 | 0.000 | 0.722 | (0;000) | ✗ | 02/02/17 |
Rb2P3 | ICSD | 654296 | Fmmm (69) | ✔ | 10 | 66 | 1 | 0.7411 | 0.741 | 0.000 | (0;000) | ✗ | 02/02/17 |
MnSbSe2I | COD | 2013470 | C2/m (12) | ✔ | 10 | 78 | 3 | 0.0 | 0.006 | 0.343 | (1;111) | ✗ | 02/02/17 |
CsCo(CO)4 | ICSD | 31359 | I-4 (82) | ✗ | 10 | 66 | 2 | 3.736 | 3.877 | 0.000 | (0;000) | ✗ | 15/02/17 |
Ca2GePd2 | COD | 4002144 | Fdd2 (43) | ✗ | 10 | 120 | 3 | 0.0 | 0.051 | 0.309 | (0;000) | ✔ | 11/04/17 |
Fe(BW)2 | COD | 1510686 | P4/mbm (127) | ✔ | 10 | 140 | 3 | 0.0 | 0.012 | 0.601 | (1;000) | ✗ | 11/04/17 |
Co(TePd)2 | ICSD | 416514 | Ibam (72) | ✔ | 10 | 130 | 3 | 0.0 | 0.000 | 0.447 | (1;001) | ✗ | 22/03/17 |
Na2CoSe2 | ICSD | 624264 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.003 | 0.333 | (0;000) | ✗ | 02/02/17 |
Nb2Se3 | ICSD | 660018 | P2_1/m (11) | ✔ | 10 | 88 | 3 | 0.0 | 0.016 | 0.190 | (1;010) | ✗ | 02/02/17 |
Ta2Te3 | ICSD | 41047 | C2/m (12) | ✔ | 10 | 88 | 3 | 0.0 | 0.027 | 0.380 | (0;111) | ✗ | 02/02/17 |
C | COD | 9012593 | R-3m (166) | ✔ | 10 | 40 | 3 | 4.5247 | 5.260 | 0.000 | (0;000) | ✗ | 22/03/17 |
In2S3 | COD | 7221366 | R-3c (167) | ✔ | 10 | 88 | 3 | 0.5499 | 0.778 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2S3 | COD | 1527164 | Cmc2_1 (36) | ✗ | 10 | 72 | 1 | 1.2787 | 1.345 | 0.000 | (0;000) | ✗ | 29/03/17 |
MgTiO3 | COD | 9010587 | R-3 (148) | ✔ | 10 | 80 | 3 | 3.7492 | 3.814 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsTiI3 | ICSD | 154258 | P6_3/mmc (194) | ✔ | 10 | 84 | 1 | 0.0 | 0.014 | 0.483 | (0;000) | ✗ | 02/02/17 |
Sb2Te3 | ICSD | 262172 | C2/m (12) | ✔ | 10 | 56 | 3 | 0.0 | 0.037 | 0.556 | (0;000) | ✗ | 02/02/17 |
KMnF3 | ICSD | 4054 | P4/mbm (127) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.805 | (0;000) | ✗ | 02/02/17 |
K2MnTe2 | ICSD | 65459 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.270 | (0;011) | ✗ | 02/02/17 |
Hf2InPd2 | ICSD | 130035 | P4/mbm (127) | ✔ | 10 | 146 | 3 | 0.0 | 0.000 | 0.983 | (0;000) | ✗ | 02/02/17 |
B2O3 | COD | 2105403 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 8.6954 | 8.982 | 0.000 | (0;000) | ✗ | 15/02/17 |
Y2MgCu2 | ICSD | 411711 | P4/mbm (127) | ✔ | 10 | 108 | 3 | 0.0 | 0.005 | 0.738 | (0;000) | ✗ | 02/02/17 |
Na2CoS2 | ICSD | 67386 | Ibam (72) | ✔ | 10 | 94 | 1 | 0.0 | 0.001 | 0.349 | (0;000) | ✗ | 02/02/17 |
Sn4Ir | ICSD | 641053 | Ccce (68) | ✔ | 10 | 146 | 3 | 0.0 | 0.000 | 0.654 | (0;000) | ✗ | 02/02/17 |
CsMnI3 | COD | 1528241 | P6_3/mmc (194) | ✔ | 10 | 90 | 1 | 0.0 | 0.001 | 0.698 | (0;000) | ✗ | 02/02/17 |
HCBr3 | COD | 1504397 | P6_3 (173) | ✗ | 10 | 52 | 1 | 3.6186 | 3.620 | 0.000 | (0;000) | ✗ | 22/03/17 |
TlPbI3 | COD | 7221381 | Cmcm (63) | ✔ | 10 | 96 | 3 | 1.3367 | 1.337 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Te3 | ICSD | 53245 | Cmc2_1 (36) | ✗ | 10 | 72 | 1 | 0.2695 | 0.326 | 0.000 | (0;000) | ✔ | 22/03/17 |
Sr2Pb3 | COD | 1518043 | P4/mbm (127) | ✔ | 10 | 124 | 2 | 0.0 | 0.043 | 0.538 | (0;000) | ✗ | 02/02/17 |
NbSe4 | ICSD | 645375 | P4cc (103) | ✗ | 10 | 74 | 3 | 0.0 | 0.000 | 0.629 | ? | ✗ | 29/03/17 |
NiPSe3 | ICSD | 646145 | C2/m (12) | ✔ | 10 | 66 | 2 | 0.0 | 0.021 | 0.226 | (0;000) | ✗ | 02/02/17 |
MgPSe3 | ICSD | 642731 | R-3 (148) | ✔ | 10 | 66 | 2 | 2.0858 | 2.086 | 0.000 | (0;000) | ✗ | 02/02/17 |
VAg(PSe3)2 | ICSD | 68143 | C2 (5) | ✗ | 10 | 70 | 2 | 0.0 | 0.007 | 0.288 | (1;100) | ✔ | 16/03/17 |
CsMgI3 | ICSD | 87262 | P6_3/mmc (194) | ✔ | 10 | 80 | 1 | 3.1028 | 3.128 | 0.000 | (0;000) | ✗ | 02/02/17 |
InSiTe3 | ICSD | 66356 | P-31m (162) | ✔ | 10 | 70 | 2 | 0.2799 | 0.602 | 0.000 | (0;000) | ✗ | 02/02/17 |
V(CrC)2 | COD | 1530865 | Cmcm (63) | ✔ | 10 | 98 | 3 | 0.0 | 0.000 | 0.958 | (0;110) | ✗ | 21/03/17 |
K2P2Pd | ICSD | 15584 | Cmcm (63) | ✔ | 10 | 92 | 1 | 1.0553 | 1.099 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsNiI3 | ICSD | 423830 | P6_3/mmc (194) | ✔ | 10 | 80 | 1 | 0.0 | 0.017 | 0.383 | (0;000) | ✗ | 02/02/17 |
Sn4Pt | COD | 1522862 | Ccce (68) | ✔ | 10 | 132 | 3 | 0.0 | 0.032 | 0.303 | (0;000) | ✗ | 02/02/17 |
Hf2InNi2 | ICSD | 407547 | P4/mbm (127) | ✔ | 10 | 114 | 3 | 0.0 | 0.000 | 0.984 | (0;000) | ✗ | 02/02/17 |
Cs2MnSe2 | ICSD | 65458 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.325 | (1;001) | ✗ | 02/02/17 |
Nb3Si2 | ICSD | 645431 | P4/mbm (127) | ✔ | 10 | 94 | 1 | 0.0 | 0.000 | 0.731 | (1;000) | ✗ | 02/02/17 |
Tl2PdSe2 | ICSD | 79601 | Pbam (55) | ✔ | 10 | 112 | 3 | 0.0 | 0.318 | 0.215 | (0;000) | ✗ | 02/02/17 |
Li2CuSn2 | ICSD | 426084 | I4_1/amd (141) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.933 | (1;111) | ✗ | 22/03/17 |
Cs2NiP2 | ICSD | 656056 | Cmcm (63) | ✔ | 10 | 76 | 2 | 0.0 | 0.006 | 0.149 | (0;000) | ✗ | 02/02/17 |
Cs3TlF6 | COD | 1529658 | I4/mmm (139) | ✔ | 10 | 82 | 3 | 3.8175 | 4.134 | 0.000 | (0;000) | ✗ | 02/02/17 |
KTi2F7 | ICSD | 174209 | Cmmm (65) | ✔ | 10 | 82 | 3 | 0.0 | 0.014 | 0.924 | (0;000) | ✗ | 04/08/17 |
Sr2InPd2 | ICSD | 391432 | C2/c (15) | ✔ | 10 | 138 | 3 | 0.0 | 0.000 | 0.527 | (0;011) | ✗ | 02/02/17 |
Te3Pt2 | ICSD | 41371 | R-3m (166) | ✔ | 10 | 76 | 3 | 0.0 | 0.026 | 0.806 | (1;111) | ✗ | 29/03/17 |
Y2InCu2 | ICSD | 628177 | P4/mbm (127) | ✔ | 10 | 114 | 3 | 0.0 | 0.000 | 0.989 | (1;111) | ✗ | 02/02/17 |
H2CClF | COD | 2013049 | P2_1 (4) | ✗ | 10 | 40 | 1 | 6.0043 | 6.037 | 0.000 | (0;000) | ✗ | 15/02/17 |
GeH3Cl | ICSD | 62109 | Cmc2_1 (36) | ✗ | 10 | 28 | 1 | 4.9989 | 5.116 | 0.000 | (0;000) | ✗ | 15/02/17 |
Ti2Cu3 | COD | 1525232 | P4/nmm (129) | ✔ | 10 | 114 | 3 | 0.0 | 0.000 | 0.864 | (1;001) | ✗ | 22/03/17 |
Zr2Ga3 | COD | 1522711 | Fdd2 (43) | ✗ | 10 | 94 | 3 | 0.0 | 0.000 | 0.885 | ? | ✗ | 15/02/17 |
MnPSe3 | ICSD | 643239 | R-3 (148) | ✔ | 10 | 76 | 2 | 0.0 | 0.010 | 0.528 | (0;000) | ✗ | 02/02/17 |
SnPS3 | ICSD | 648056 | C2/m (12) | ✔ | 10 | 74 | 2 | 0.0 | 0.016 | 0.440 | (0;000) | ✗ | 02/02/17 |
Rb2MnTe2 | ICSD | 65460 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.275 | (0;000) | ✗ | 02/02/17 |
Sr2I2O | COD | 8102957 | Ibam (72) | ✔ | 10 | 80 | 1 | 3.1001 | 3.225 | 0.000 | (0;000) | ✗ | 02/02/17 |
Hf2Al3 | ICSD | 608101 | Fdd2 (43) | ✗ | 10 | 66 | 3 | 0.0 | 0.000 | 0.865 | ? | ✗ | 15/02/17 |
LiCo(CO)4 | ICSD | 30854 | P-43m (215) | ✗ | 10 | 60 | 3 | 4.0417 | 4.042 | 0.000 | (0;000) | ✗ | 15/02/17 |
Sr3Hg2 | ICSD | 107371 | P4/mbm (127) | ✔ | 10 | 108 | 1 | 0.0 | 0.024 | 0.727 | (0;000) | ✗ | 02/02/17 |
CrGeTe3 | ICSD | 79270 | R-3 (148) | ✔ | 10 | 72 | 2 | 0.0 | 0.031 | 0.084 | (1;111) | ✗ | 02/02/17 |
Cs2P3 | ICSD | 65185 | Fmmm (69) | ✔ | 10 | 66 | 1 | 0.8432 | 0.843 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2KYF6 | ICSD | 155977 | Fm-3m (225) | ✔ | 10 | 80 | 1 | 6.8517 | 6.852 | 0.000 | (0;000) | ✗ | 02/02/17 |
KPS3 | ICSD | 33278 | Immm (71) | ✔ | 10 | 64 | 1 | 1.7043 | 1.718 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2SiP2 | COD | 1008522 | Ibam (72) | ✔ | 10 | 64 | 1 | 1.3238 | 1.545 | 0.000 | (0;000) | ✗ | 02/02/17 |
Si2Mo3 | ICSD | 644412 | P4/mbm (127) | ✔ | 10 | 100 | 1 | 0.0 | 0.002 | 0.589 | (0;000) | ✗ | 02/02/17 |
SrGa3Pd | ICSD | 192026 | Cmcm (63) | ✔ | 10 | 134 | 3 | 0.0 | 0.000 | 0.698 | (1;000) | ✗ | 02/02/17 |
Cs2Sb2Pt | ICSD | 658700 | Cmcm (63) | ✔ | 10 | 76 | 3 | 0.687 | 0.891 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3Mo(OF)3 | ICSD | 97452 | R3 (146) | ✗ | 10 | 80 | 1 | 3.9124 | 4.098 | 0.000 | (0;000) | ✗ | 15/02/17 |
WCl4 | ICSD | 165263 | C2/m (12) | ✔ | 10 | 112 | 1 | 0.1244 | 0.269 | 0.000 | (0;000) | ✗ | 11/04/17 |
Sr2MnSbO6 | COD | 2101591 | I4mm (107) | ✗ | 10 | 76 | 3 | 0.0 | 0.011 | 0.791 | ? | ✗ | 15/02/17 |
RbTiBr3 | ICSD | 154257 | P6_3/mmc (194) | ✔ | 10 | 84 | 1 | 0.0 | 0.017 | 0.528 | (0;000) | ✗ | 02/02/17 |
RbVBr3 | COD | 1530069 | P6_3/mmc (194) | ✔ | 10 | 86 | 1 | 0.0 | 0.000 | 0.658 | (0;000) | ✗ | 02/02/17 |
Cs2NaBiCl6 | ICSD | 59195 | Fm-3m (225) | ✔ | 10 | 84 | 2 | 2.9309 | 3.206 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZnGeO3 | ICSD | 33722 | R-3 (148) | ✔ | 10 | 68 | 3 | 2.5296 | 2.693 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zr2CoSi2 | ICSD | 653752 | C2/m (12) | ✔ | 10 | 66 | 3 | 0.0 | 0.009 | 0.595 | (0;111) | ✗ | 27/01/17 |
Mg3As2 | ICSD | 24485 | Pn-3m (224) | ✔ | 10 | 80 | 3 | 0.7835 | 0.869 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlBiO3 | ICSD | 171708 | R3c (161) | ✗ | 10 | 52 | 3 | 2.5618 | 2.727 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlBiO3 | ICSD | 185508 | R3c (161) | ✗ | 10 | 52 | 3 | 2.9662 | 2.992 | 0.000 | (0;000) | ✗ | 06/10/16 |
Rb2NaYF6 | ICSD | 25369 | Fm-3m (225) | ✔ | 10 | 80 | 2 | 6.6501 | 6.650 | 0.000 | (0;000) | ✗ | 27/01/17 |
Si2N2O | ICSD | 98639 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 4.9363 | 4.936 | 0.000 | (0;000) | ✗ | 06/10/16 |
NaHCO2 | ICSD | 151320 | C2/c (15) | ✔ | 10 | 52 | 1 | 4.7608 | 4.824 | 0.000 | (0;000) | ✗ | 27/01/17 |
PPdS3 | ICSD | 647926 | C2/m (12) | ✔ | 10 | 82 | 2 | 0.0 | 0.012 | 0.185 | (0;000) | ✗ | 27/01/17 |
SnPS3 | ICSD | 648055 | R-3 (148) | ✔ | 10 | 74 | 2 | 0.0 | 0.207 | 0.338 | (0;000) | ✗ | 27/01/17 |
Rb2NaVF6 | ICSD | 27346 | Fm-3m (225) | ✔ | 10 | 82 | 1 | 0.0 | 0.000 | 0.478 | (0;000) | ✗ | 27/01/17 |
IrF4 | ICSD | 23483 | F2dd (43) | ✗ | 10 | 74 | 3 | 0.0 | 0.000 | 0.301 | (1;000) | ✔ | 06/10/16 |
VPS3 | ICSD | 648076 | C2/m (12) | ✔ | 10 | 72 | 2 | 0.1508 | 0.195 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZnPS3 | ICSD | 648084 | C2/m (12) | ✔ | 10 | 70 | 2 | 1.9444 | 2.418 | 0.000 | (0;000) | ✗ | 27/01/17 |