▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Na2Zn2O3 | ICSD | 25617 | P2_1/c (14) | ✔ | 14 | 120 | 3 | 1.1217 | 1.122 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2GeO4 | ICSD | 182051 | P-3m1 (164) | ✔ | 14 | 96 | 1 | 1.1021 | 1.102 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2SO4 | ICSD | 27955 | P-3m1 (164) | ✔ | 14 | 96 | 1 | 0.0 | 0.000 | 0.521 | (1;000) | ✗ | 27/01/17 |
Ca2PbO4 | COD | 2002530 | Pbam (55) | ✔ | 14 | 116 | 1 | 1.7129 | 1.926 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2SiO4 | ICSD | 182052 | P-3m1 (164) | ✔ | 14 | 96 | 1 | 0.9223 | 0.925 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2SnO4 | COD | 1529022 | Pbam (55) | ✔ | 14 | 116 | 1 | 3.0356 | 3.056 | 0.000 | (0;000) | ✗ | 27/01/17 |
Nb2O2F3 | COD | 4123273 | C2/c (15) | ✔ | 14 | 118 | 3 | 0.0 | 0.000 | 0.850 | (1;100) | ✗ | 27/01/17 |
Rb3Na(MoO4)2 | ICSD | 191958 | P-3m1 (164) | ✔ | 14 | 112 | 1 | 4.7708 | 4.771 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sc2MnSe4 | ICSD | 74407 | Fd-3m (227) | ✔ | 14 | 122 | 3 | 0.0 | 0.000 | 0.795 | (0;000) | ✗ | 02/02/17 |
Mo3S4 | COD | 4335444 | P-1 (2) | ✔ | 14 | 132 | 3 | 0.0 | 0.031 | 0.280 | (1;001) | ✗ | 02/02/17 |
Rb(MoS)3 | ICSD | 30753 | P6_3/m (176) | ✔ | 14 | 138 | 1 | 0.0 | 0.000 | 0.273 | (0;000) | ✗ | 02/02/17 |
CaCrF5 | COD | 1525475 | C2/c (15) | ✔ | 14 | 118 | 1 | 0.0 | 0.001 | 0.567 | (1;011) | ✗ | 27/01/17 |
Mo3S4 | ICSD | 644244 | R-3 (148) | ✔ | 14 | 132 | 3 | 0.0 | 0.059 | 0.528 | (0;111) | ✗ | 02/02/17 |
Rb(MoSe)3 | ICSD | 603629 | P6_3/m (176) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.308 | (0;000) | ✗ | 02/02/17 |
Rb(MoS)3 | ICSD | 644175 | P6_3/m (176) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.286 | (0;000) | ✗ | 02/02/17 |
Te4Mo3 | COD | 2007309 | R-3 (148) | ✔ | 14 | 132 | 3 | 0.0 | 0.095 | 0.033 | (1;111) | ✗ | 02/02/17 |
Mo3Se4 | ICSD | 644349 | R-3 (148) | ✔ | 14 | 132 | 3 | 0.0 | 0.052 | 0.413 | (1;111) | ✗ | 02/02/17 |
Tl(MoSe)3 | ICSD | 603627 | P6_3/m (176) | ✔ | 14 | 146 | 3 | 0.0 | 0.000 | 0.303 | (0;000) | ✗ | 02/02/17 |
Tl(MoSe)3 | ICSD | 53119 | P6_3/m (176) | ✔ | 14 | 146 | 1 | 0.0 | 0.000 | 0.290 | (0;000) | ✗ | 02/02/17 |
Tl(TeMo)3 | COD | 1521172 | P6_3/m (176) | ✔ | 14 | 146 | 3 | 0.0 | 0.000 | 0.290 | (0;000) | ✗ | 02/02/17 |
CaH2F4 | ICSD | 419144 | Fddd (70) | ✔ | 14 | 80 | 1 | 7.8159 | 7.816 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeMoClO4 | ICSD | 202186 | P4/nmm (129) | ✔ | 14 | 106 | 3 | 0.0 | 0.000 | 0.921 | (1;000) | ✗ | 02/02/17 |
Tl(TeMo)3 | ICSD | 603670 | P6_3/m (176) | ✔ | 14 | 146 | 3 | 0.0 | 0.000 | 0.321 | (1;000) | ✗ | 02/02/17 |
Sr4Li(BN2)3 | ICSD | 402173 | Im-3m (229) | ✔ | 14 | 82 | 1 | 2.0978 | 2.998 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs(BH)3 | ICSD | 65508 | Fm-3m (225) | ✔ | 14 | 42 | 2 | 4.0127 | 4.210 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba4Na(BN2)3 | ICSD | 401210 | Im-3m (229) | ✔ | 14 | 88 | 1 | 2.0643 | 2.504 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaSr4(BN2)3 | ICSD | 92577 | Im-3m (229) | ✔ | 14 | 88 | 1 | 2.009 | 2.830 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3CoO3 | ICSD | 99580 | P-1 (2) | ✔ | 14 | 124 | 1 | 0.0 | 0.002 | 0.212 | (0;001) | ✗ | 27/01/17 |
Rb2Mo(SO)2 | ICSD | 423992 | C2/c (15) | ✔ | 14 | 112 | 1 | 2.2015 | 2.383 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sc5NCl8 | ICSD | 60856 | C2/m (12) | ✔ | 14 | 116 | 3 | 0.0 | 0.006 | 0.132 | (0;110) | ✗ | 02/02/17 |
Ba2Mn2Sb2O | ICSD | 16360 | P6_3/mmc (194) | ✔ | 14 | 132 | 2 | 0.0 | 0.008 | 0.838 | (1;000) | ✗ | 02/02/17 |
Fe3O4 | ICSD | 65338 | F-43m (216) | ✗ | 14 | 96 | 3 | 0.0 | 0.000 | 0.592 | ? | ✗ | 15/02/17 |
Na2SrSn4 | COD | 8103057 | C2/c (15) | ✔ | 14 | 168 | 1 | 0.0 | 0.036 | 0.351 | (0;000) | ✗ | 02/02/17 |
Rb2MoO4 | ICSD | 24904 | C2/m (12) | ✔ | 14 | 112 | 1 | 3.6232 | 3.714 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba2Cd2Sb3 | COD | 7024288 | C2/m (12) | ✔ | 14 | 118 | 1 | 0.0 | 0.020 | 0.063 | (1;110) | ✗ | 02/02/17 |
Ba2Mn2Bi2O | ICSD | 16361 | P6_3/mmc (194) | ✔ | 14 | 172 | 2 | 0.0 | 0.002 | 0.876 | (1;000) | ✗ | 02/02/17 |
NaV2O4 | COD | 4330682 | C2/c (15) | ✔ | 14 | 118 | 2 | 0.0 | 0.000 | 0.511 | (0;101) | ✗ | 27/01/17 |
Ba2InClO3 | ICSD | 81877 | P4/nmm (129) | ✔ | 14 | 116 | 1 | 2.1009 | 2.590 | 0.000 | (0;000) | ✗ | 02/02/17 |
S3(NO)2 | COD | 7221380 | C2/c (15) | ✔ | 14 | 80 | 1 | 1.5897 | 1.717 | 0.000 | (0;000) | ✗ | 02/02/17 |
Tl2MoO4 | COD | 2009101 | P-3m1 (164) | ✔ | 14 | 128 | 3 | 3.034 | 3.116 | 0.000 | (0;000) | ✗ | 02/02/17 |
SeS2(NO)2 | ICSD | 69978 | C2/c (15) | ✔ | 14 | 80 | 1 | 1.8532 | 1.897 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba2InBrO3 | ICSD | 81878 | P4/nmm (129) | ✔ | 14 | 116 | 2 | 2.0352 | 2.422 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaIn2O4 | ICSD | 52390 | I4_1/amd (141) | ✔ | 14 | 120 | 3 | 2.1818 | 2.208 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2CoClO3 | ICSD | 91750 | P4/nmm (129) | ✔ | 14 | 124 | 1 | 0.0 | 0.018 | 0.197 | (0;001) | ✗ | 02/02/17 |
Nb2O5 | COD | 1528678 | C2/c (15) | ✔ | 14 | 112 | 3 | 2.7685 | 2.894 | 0.000 | (0;000) | ✗ | 27/01/17 |
S3(NO)2 | COD | 7221393 | C2/c (15) | ✔ | 14 | 80 | 1 | 1.241 | 1.348 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ge3N4 | ICSD | 637157 | P6_3/m (176) | ✔ | 14 | 64 | 3 | 2.2501 | 2.250 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2InO3F | ICSD | 81876 | P4/nmm (129) | ✔ | 14 | 116 | 1 | 2.2156 | 2.759 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba2GeSe4 | ICSD | 414166 | P2_1/m (11) | ✔ | 14 | 96 | 1 | 1.4911 | 1.491 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba2Ge(TeSe)2 | ICSD | 414165 | P2_1/m (11) | ✔ | 14 | 96 | 1 | 0.8686 | 0.869 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ge3N4 | ICSD | 97568 | Fd-3m (227) | ✔ | 14 | 64 | 3 | 1.9214 | 1.958 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaN6 | ICSD | 412259 | Fddd (70) | ✔ | 14 | 80 | 1 | 3.4748 | 3.475 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaCaVO4 | ICSD | 28121 | Cmcm (63) | ✔ | 14 | 112 | 1 | 4.1787 | 4.266 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaCaVO4 | ICSD | 32573 | Cmcm (63) | ✔ | 14 | 112 | 1 | 3.467 | 3.486 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2FeClO3 | ICSD | 93508 | P4/nmm (129) | ✔ | 14 | 106 | 1 | 0.0 | 0.000 | 0.744 | (0;000) | ✗ | 02/02/17 |
Rb3Na(RuO4)2 | ICSD | 416038 | P-3m1 (164) | ✔ | 14 | 116 | 1 | 0.0 | 0.003 | 0.072 | (0;001) | ✗ | 02/02/17 |
Y2C(NO)2 | ICSD | 245333 | P6_3/mmc (194) | ✔ | 14 | 96 | 3 | 2.8762 | 3.111 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca(PtO2)2 | ICSD | 6159 | P4_2/mmc (131) | ✔ | 14 | 108 | 3 | 0.0 | 0.008 | 0.364 | (1;000) | ✗ | 27/01/17 |
Co(RhO2)2 | ICSD | 109301 | Fd-3m (227) | ✔ | 14 | 150 | 3 | 0.0 | 0.000 | 0.189 | (0;000) | ✗ | 27/01/17 |
CaTl2O4 | COD | 1000379 | Cmcm (63) | ✔ | 14 | 120 | 3 | 0.0168 | 0.077 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2SiTe4 | ICSD | 49751 | P2_1/m (11) | ✔ | 14 | 96 | 1 | 0.9821 | 1.021 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba2SiSe4 | ICSD | 49750 | P2_1/m (11) | ✔ | 14 | 96 | 1 | 2.3537 | 2.365 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaPPdS4 | ICSD | 97456 | I4/mcm (140) | ✔ | 14 | 112 | 1 | 1.1547 | 1.399 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba3CdHg10 | ICSD | 290306 | Immm (71) | ✔ | 14 | 162 | 3 | 0.0 | 0.021 | 0.529 | (0;111) | ✗ | 02/02/17 |
NbPO5 | COD | 1517726 | P4/nmm (129) | ✔ | 14 | 96 | 3 | 3.3846 | 3.666 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrN6 | ICSD | 35226 | Fddd (70) | ✔ | 14 | 80 | 1 | 3.6409 | 3.751 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaSi6 | ICSD | 237248 | Cmcm (63) | ✔ | 14 | 66 | 3 | 0.0 | 0.000 | 0.792 | (0;111) | ✗ | 02/02/17 |
Na2PdF4 | ICSD | 71101 | P2_1/c (14) | ✔ | 14 | 128 | 1 | 1.3759 | 1.415 | 0.000 | (0;000) | ✗ | 27/01/17 |
Nb3Se4 | COD | 1528080 | P6_3/m (176) | ✔ | 14 | 126 | 3 | 0.0 | 0.000 | 0.972 | (1;000) | ✗ | 02/02/17 |
Ba4P2O | ICSD | 33906 | Cmce (64) | ✔ | 14 | 112 | 1 | 0.8159 | 0.816 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb3S4 | ICSD | 645317 | P6_3/m (176) | ✔ | 14 | 126 | 3 | 0.0 | 0.000 | 0.961 | (1;000) | ✗ | 02/02/17 |
Ba3CrN3 | ICSD | 154802 | P6_3/m (176) | ✔ | 14 | 118 | 1 | 0.0 | 0.000 | 0.336 | (0;000) | ✗ | 02/02/17 |
Si(NiO2)2 | COD | 9005829 | Fd-3m (227) | ✔ | 14 | 96 | 3 | 0.0 | 0.006 | 0.582 | (0;000) | ✗ | 27/01/17 |
Nb3Te4 | COD | 2310663 | P6_3/m (176) | ✔ | 14 | 126 | 3 | 0.0 | 0.000 | 0.974 | (0;000) | ✗ | 02/02/17 |
Ba3(GeN)2 | COD | 1005031 | P2_1/m (11) | ✔ | 14 | 96 | 1 | 0.0 | 0.017 | 0.965 | (0;010) | ✗ | 02/02/17 |
Nb3Te4 | ICSD | 602365 | P6_3/m (176) | ✔ | 14 | 126 | 3 | 0.0 | 0.000 | 0.804 | (1;000) | ✗ | 02/02/17 |
Ba3FeN3 | ICSD | 36502 | P6_3/m (176) | ✔ | 14 | 106 | 1 | 0.0 | 0.000 | 0.973 | (1;000) | ✗ | 02/02/17 |
Co2CuS4 | COD | 9009688 | Fd-3m (227) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.886 | (0;000) | ✗ | 02/02/17 |
Ni(RhS2)2 | ICSD | 646317 | Fd-3m (227) | ✔ | 14 | 136 | 3 | 0.0 | 0.003 | 0.498 | (0;000) | ✗ | 02/02/17 |
Y3GaCo3 | COD | 1525482 | Cmcm (63) | ✔ | 14 | 194 | 3 | 0.0 | 0.000 | 0.884 | (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 |
Sr2NiClO3 | ICSD | 237581 | P4/nmm (129) | ✔ | 14 | 110 | 1 | 0.0 | 0.000 | 0.901 | (0;000) | ✗ | 02/02/17 |
Co2NiS4 | ICSD | 624468 | Fd-3m (227) | ✔ | 14 | 136 | 3 | 0.0 | 0.030 | 0.439 | (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 |
YMoClO4 | COD | 4304780 | C2/m (12) | ✔ | 14 | 112 | 3 | 2.7876 | 3.153 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ni(RhO2)2 | ICSD | 23487 | I4_1/amd (141) | ✔ | 14 | 136 | 3 | 0.0 | 0.001 | 0.403 | (1;111) | ✗ | 27/01/17 |
Ba3MnN3 | ICSD | 80771 | P6_3/m (176) | ✔ | 14 | 120 | 1 | 0.0 | 0.001 | 0.960 | (1;000) | ✗ | 02/02/17 |
NbNiTe5 | ICSD | 73316 | Cmcm (63) | ✔ | 14 | 106 | 2 | 0.0 | 0.000 | 0.922 | (0;110) | ✗ | 02/02/17 |
Ni3S4 | COD | 9009863 | Fd-3m (227) | ✔ | 14 | 108 | 3 | 0.0 | 0.198 | 0.596 | (0;000) | ✗ | 02/02/17 |
Sr(Ni2Sn)2 | ICSD | 418131 | I4/mcm (140) | ✔ | 14 | 156 | 3 | 0.0 | 0.001 | 0.333 | (1;111) | ✗ | 02/02/17 |
Y(Ni2P)2 | ICSD | 189495 | P4_2/mnm (136) | ✔ | 14 | 122 | 3 | 0.0 | 0.000 | 0.949 | (1;000) | ✗ | 27/01/17 |
Zr(Ni2P)2 | ICSD | 76681 | P4_2/mnm (136) | ✔ | 14 | 108 | 3 | 0.0 | 0.031 | 0.512 | (1;000) | ✗ | 27/01/17 |
Sr(NiP2)2 | COD | 4002218 | Fddd (70) | ✔ | 14 | 100 | 2 | 0.0 | 0.006 | 0.534 | (1;111) | ✗ | 02/02/17 |
K4P3 | ICSD | 64625 | Cmcm (63) | ✔ | 14 | 102 | 1 | 0.0 | 0.000 | 0.967 | (1;000) | ✗ | 02/02/17 |
V2O5 | ICSD | 156052 | C2/c (15) | ✔ | 14 | 112 | 3 | 1.3792 | 1.492 | 0.000 | (0;000) | ✗ | 27/01/17 |
Pb3O4 | ICSD | 97282 | Pbam (55) | ✔ | 14 | 132 | 3 | 0.0 | 0.004 | 0.290 | (1;100) | ✗ | 02/02/17 |
Zr(SiPd)3 | COD | 4001641 | Cmcm (63) | ✔ | 14 | 140 | 3 | 0.0 | 0.010 | 0.671 | (1;000) | ✗ | 02/02/17 |
Y3Pd4 | ICSD | 649109 | R-3 (148) | ✔ | 14 | 210 | 3 | 0.0 | 0.001 | 0.587 | (1;111) | ✗ | 02/02/17 |
Hf3N4 | ICSD | 97997 | I-43d (220) | ✗ | 14 | 112 | 3 | 0.9972 | 0.999 | 0.000 | (0;000) | ✗ | 15/02/17 |
Zr3Pd4 | ICSD | 186415 | R-3 (148) | ✔ | 14 | 168 | 3 | 0.0 | 0.000 | 0.709 | (1;000) | ✗ | 02/02/17 |