▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
AgCNO | ICSD | 27678 | Cmmm (65) | ✔ | 4 | 26 | 1 | 0.0 | 0.106 | 0.264 | (0;110) | ✗ | 27/01/17 |
AgCNO | ICSD | 260378 | Pmmn (59) | ✔ | 8 | 52 | 3 | 1.449 | 1.655 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrS2 | ICSD | 642 | I4/mcm (140) | ✔ | 6 | 44 | 1 | 1.3022 | 2.079 | 0.000 | (0;000) | ✗ | 27/01/17 |
AgCNO | ICSD | 23832 | Cmcm (63) | ✔ | 8 | 52 | 3 | 2.1874 | 2.631 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaZnGe | ICSD | 52772 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.183 | 0.172 | (0;000) | ✗ | 27/01/17 |
CaNiGe | ICSD | 418852 | P4/nmm (129) | ✔ | 6 | 48 | 2 | 0.0 | 0.002 | 0.796 | (0;001) | ✗ | 27/01/17 |
CaMnGe | COD | 9008361 | P4/nmm (129) | ✔ | 6 | 58 | 1 | 0.0 | 0.000 | 0.847 | (0;000) | ✗ | 27/01/17 |
CaMnGe | ICSD | 66957 | P4/nmm (129) | ✔ | 6 | 58 | 2 | 0.0 | 0.000 | 0.865 | (1;000) | ✗ | 27/01/17 |
CaNiGeH | ICSD | 263028 | P4/nmm (129) | ✔ | 8 | 50 | 1 | 0.0 | 0.000 | 0.741 | (1;000) | ✗ | 27/01/17 |
Ca(ZnGe)2 | ICSD | 25319 | I4/mmm (139) | ✔ | 5 | 42 | 3 | 0.0 | 0.031 | 0.386 | (1;111) | ✗ | 27/01/17 |
Ca(GeRu)2 | ICSD | 52761 | I4/mmm (139) | ✔ | 5 | 50 | 3 | 0.0 | 0.002 | 0.499 | (1;000) | ✗ | 27/01/17 |
Ca(GeRh)2 | ICSD | 52760 | I4/mmm (139) | ✔ | 5 | 52 | 3 | 0.0 | 0.013 | 0.621 | (1;111) | ✗ | 27/01/17 |
Ca(GePd)2 | ICSD | 52759 | I4/mmm (139) | ✔ | 5 | 54 | 3 | 0.0 | 0.005 | 0.701 | (0;000) | ✗ | 27/01/17 |
CaGe2O5 | COD | 8103645 | P-1 (2) | ✔ | 16 | 96 | 3 | 2.9045 | 2.938 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaNiGe2 | ICSD | 240342 | Cmcm (63) | ✔ | 8 | 56 | 3 | 0.0 | 0.008 | 0.712 | (0;110) | ✗ | 27/01/17 |
Ca(NiGe)2 | ICSD | 408 | I4/mmm (139) | ✔ | 5 | 38 | 3 | 0.0 | 0.011 | 0.725 | (0;111) | ✗ | 27/01/17 |
Ca(MnGe)2 | ICSD | 81743 | I4/mmm (139) | ✔ | 5 | 48 | 3 | 0.0 | 0.001 | 0.817 | (1;000) | ✗ | 27/01/17 |
Ca(GeIr)2 | ICSD | 52755 | I4/mmm (139) | ✔ | 5 | 52 | 3 | 0.0 | 0.072 | 0.573 | (1;111) | ✗ | 27/01/17 |
CaGe2 | ICSD | 77316 | R-3m (166) | ✔ | 3 | 18 | 1 | 0.0 | 0.016 | 0.347 | (0;000) | ✗ | 27/01/17 |
CaGe2 | ICSD | 619304 | R-3m (166) | ✔ | 6 | 36 | 1 | 0.0 | 0.027 | 0.180 | (1;000) | ✗ | 27/01/17 |
CaGaN | COD | 2106735 | P4/nmm (129) | ✔ | 6 | 56 | 1 | 0.0 | 0.003 | 0.529 | (1;000) | ✗ | 27/01/17 |
CaGa | ICSD | 619272 | Cmcm (63) | ✔ | 4 | 46 | 1 | 0.0 | 0.000 | 0.934 | (0;110) | ✗ | 27/01/17 |
CaGa4 | ICSD | 58892 | I4/mmm (139) | ✔ | 5 | 62 | 3 | 0.0 | 0.002 | 0.293 | (1;000) | ✗ | 27/01/17 |
CaGa3Ni2 | ICSD | 58898 | Cmcm (63) | ✔ | 12 | 138 | 3 | 0.0 | 0.000 | 0.886 | (0;110) | ✗ | 27/01/17 |
CaGa2Ni | COD | 8103269 | Cmcm (63) | ✔ | 8 | 92 | 3 | 0.0 | 0.006 | 0.691 | (1;000) | ✗ | 27/01/17 |
CaGa2 | ICSD | 619281 | Cmmm (65) | ✔ | 9 | 108 | 1 | 0.0 | 0.000 | 0.584 | (0;011) | ✗ | 27/01/17 |
CaGa2 | ICSD | 58891 | P6_3/mmc (194) | ✔ | 6 | 72 | 2 | 0.0 | 0.018 | 0.221 | (0;000) | ✗ | 27/01/17 |
Ag2CO3 | COD | 1007035 | P2_1/m (11) | ✔ | 12 | 88 | 3 | 0.6496 | 1.356 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaFeO2 | COD | 4124115 | P4/mmm (123) | ✔ | 4 | 30 | 2 | 0.0 | 0.009 | 0.726 | (0;000) | ✗ | 27/01/17 |
Ca(FeSi)2 | ICSD | 425467 | I4/mmm (139) | ✔ | 5 | 34 | 3 | 0.0 | 0.011 | 0.645 | (1;000) | ✗ | 27/01/17 |
Rb | ICSD | 109019 | Cmce (64) | ✔ | 8 | 72 | 3 | 0.0 | 0.019 | 0.537 | (1;110) | ✗ | 27/01/17 |
Ca(FeP)2 | COD | 7221157 | I4/mmm (139) | ✔ | 5 | 36 | 2 | 0.0 | 0.003 | 0.585 | (1;000) | ✗ | 27/01/17 |
CaTiF6 | COD | 1533036 | R-3m (166) | ✔ | 8 | 64 | 3 | 3.9477 | 3.948 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaSnF6 | ICSD | 35713 | Fm-3m (225) | ✔ | 8 | 66 | 1 | 6.1583 | 6.158 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaSiF6 | ICSD | 183914 | R-3 (148) | ✔ | 8 | 56 | 1 | 7.7957 | 7.796 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaPtF6 | ICSD | 37443 | R-3 (148) | ✔ | 8 | 62 | 1 | 2.8543 | 2.877 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaPdF6 | ICSD | 26164 | R-3 (148) | ✔ | 8 | 70 | 1 | 2.28 | 2.280 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaPbF6 | ICSD | 25522 | Fm-3m (225) | ✔ | 8 | 66 | 3 | 3.1951 | 3.195 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaZnF4 | COD | 1529060 | I4_1/a (88) | ✔ | 12 | 100 | 1 | 5.3128 | 5.313 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaPdF4 | ICSD | 32674 | I4/mcm (140) | ✔ | 12 | 112 | 1 | 1.0496 | 1.050 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaH2F4 | ICSD | 419144 | Fddd (70) | ✔ | 14 | 80 | 1 | 7.8159 | 7.816 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbCaF3 | COD | 1530112 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 6.635 | 6.752 | 0.000 | (0;000) | ✗ | 27/01/17 |
KCaF3 | ICSD | 154074 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 6.2019 | 6.356 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaF2 | ICSD | 656449 | Pnma (62) | ✔ | 12 | 96 | 1 | 8.4981 | 8.498 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaCuP | ICSD | 49740 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.0 | 0.861 | 0.050 | (0;000) | ✗ | 27/01/17 |
CaIn2Cu | COD | 1528108 | Cmcm (63) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.762 | (0;110) | ✗ | 27/01/17 |
CaCuF4 | ICSD | 9928 | I4/mcm (140) | ✔ | 12 | 98 | 1 | 0.0 | 0.001 | 0.620 | (0;000) | ✗ | 27/01/17 |
Ca(CuSn)2 | ICSD | 417717 | C2/m (12) | ✔ | 5 | 60 | 3 | 0.0 | 0.067 | 0.632 | (1;000) | ✗ | 27/01/17 |
Ca(SiCu)2 | ICSD | 619238 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.025 | 0.779 | (0;000) | ✗ | 27/01/17 |
Ca(CuS)2 | COD | 4001658 | P-3m1 (164) | ✔ | 5 | 44 | 2 | 1.0638 | 1.064 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca(CuP)2 | ICSD | 41756 | I4/mmm (139) | ✔ | 5 | 42 | 2 | 0.0 | 0.004 | 0.354 | (1;111) | ✗ | 27/01/17 |
CaCu2O3 | COD | 2002243 | Pmmn (59) | ✔ | 12 | 100 | 3 | 0.0 | 0.009 | 0.954 | (0;000) | ✗ | 27/01/17 |
Ca(CuGe)2 | ICSD | 619230 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.030 | 0.787 | (0;000) | ✗ | 27/01/17 |
Cs2CaF4 | ICSD | 82616 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 6.3925 | 6.507 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaCrO4 | COD | 1010939 | I4_1/amd (141) | ✔ | 12 | 96 | 1 | 2.8326 | 2.833 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaCrF6 | COD | 1525280 | R-3 (148) | ✔ | 8 | 66 | 1 | 0.0 | 0.021 | 0.350 | (0;000) | ✗ | 27/01/17 |
CaCrF5 | COD | 1525475 | C2/c (15) | ✔ | 14 | 118 | 1 | 0.0 | 0.001 | 0.567 | (1;011) | ✗ | 27/01/17 |
CaCuSb | ICSD | 42137 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.463 | 0.122 | (0;000) | ✗ | 27/01/17 |
CaCoSi | ICSD | 428148 | P4/nmm (129) | ✔ | 6 | 62 | 1 | 0.0 | 0.000 | 0.814 | (0;001) | ✗ | 27/01/17 |
Ca(CoSi)2 | ICSD | 420974 | I4/mmm (139) | ✔ | 5 | 52 | 3 | 0.0 | 0.022 | 0.623 | (1;111) | ✗ | 27/01/17 |
Ca(CoP)2 | ICSD | 10462 | I4/mmm (139) | ✔ | 5 | 54 | 2 | 0.0 | 0.019 | 0.401 | (0;111) | ✗ | 27/01/17 |
Ca(CoGe)2 | ICSD | 406 | I4/mmm (139) | ✔ | 5 | 52 | 3 | 0.0 | 0.024 | 0.628 | (1;111) | ✗ | 27/01/17 |
CaCl | COD | 9008985 | P4/nmm (129) | ✔ | 4 | 34 | 1 | 0.0 | 0.000 | 0.749 | (1;001) | ✗ | 27/01/17 |
CaHCl | COD | 9009165 | P4/nmm (129) | ✔ | 6 | 36 | 1 | 4.3405 | 4.341 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaClF | COD | 9011173 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 5.6094 | 5.609 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaFeClO2 | ICSD | 96556 | C2/m (12) | ✔ | 10 | 74 | 1 | 0.0 | 0.021 | 0.595 | (0;000) | ✗ | 27/01/17 |
CaCl2 | COD | 9009084 | Pnnm (58) | ✔ | 6 | 48 | 1 | 5.3948 | 5.395 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaCd | ICSD | 619188 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.668 | (0;111) | ✗ | 27/01/17 |
Ca(CdSb)2 | COD | 7221360 | P-3m1 (164) | ✔ | 5 | 44 | 2 | 0.0 | 0.081 | 0.045 | (0;000) | ✗ | 27/01/17 |
Ca(CdP)2 | COD | 7221218 | P-3m1 (164) | ✔ | 5 | 44 | 2 | 0.8743 | 0.874 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaCd2 | ICSD | 58875 | Imma (74) | ✔ | 6 | 68 | 3 | 0.0 | 0.019 | 0.523 | (1;111) | ✗ | 27/01/17 |
Ca4Sb2O | COD | 7221475 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 0.7252 | 0.988 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca4P2O | ICSD | 402952 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 1.2767 | 1.470 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca3Pb | ICSD | 58921 | Pm-3m (221) | ✔ | 4 | 44 | 1 | 0.0 | 0.000 | 0.240 | (1;111) | ✗ | 27/01/17 |
Ca3SnO | COD | 1525461 | Pm-3m (221) | ✔ | 5 | 50 | 1 | 0.0 | 0.019 | 0.016 | (0;000) | ✗ | 27/01/17 |
Ca3PbO | COD | 1525462 | Pm-3m (221) | ✔ | 5 | 50 | 1 | 0.0 | 0.016 | 0.004 | (0;000) | ✗ | 27/01/17 |
Ca3V2O8 | COD | 9014364 | C2/m (12) | ✔ | 13 | 104 | 1 | 3.4615 | 3.672 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca3(PO4)2 | COD | 9005865 | R-3m (166) | ✔ | 13 | 88 | 1 | 5.5912 | 5.591 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca3TlN | ICSD | 411448 | Pm-3m (221) | ✔ | 5 | 48 | 1 | 0.0 | 0.000 | 0.648 | (1;000) | ✗ | 27/01/17 |
Ca3SbN | COD | 1527234 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 0.0 | 0.000 | 0.154 | (0;000) | ✗ | 27/01/17 |
Ca3PN | COD | 1527232 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 0.8179 | 0.818 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca3N2 | ICSD | 419865 | R-3c (167) | ✔ | 10 | 80 | 1 | 0.792 | 0.955 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca3N2 | ICSD | 169727 | P-3m1 (164) | ✔ | 5 | 40 | 2 | 0.4458 | 0.504 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li4Ca3(SiN3)2 | ICSD | 420675 | C2/m (12) | ✔ | 15 | 80 | 1 | 2.3217 | 2.395 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca3GeO | ICSD | 402087 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 0.0 | 0.015 | 0.008 | (0;000) | ✗ | 27/01/17 |
Ca3PCl3 | COD | 1530047 | Pm-3m (221) | ✔ | 7 | 56 | 1 | 1.8056 | 1.806 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2Pt3O8 | ICSD | 65412 | R-3m (166) | ✔ | 13 | 98 | 1 | 1.149 | 1.308 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2TiSiO6 | COD | 9006455 | Fm-3m (225) | ✔ | 10 | 72 | 3 | 3.211 | 3.211 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2PdWO6 | ICSD | 83258 | Fm-3m (225) | ✔ | 10 | 88 | 3 | 0.0 | 0.000 | 0.719 | (0;000) | ✗ | 27/01/17 |
Ca2SnO4 | COD | 1529022 | Pbam (55) | ✔ | 14 | 116 | 1 | 3.0356 | 3.056 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2SiO4 | ICSD | 40657 | I4/mmm (139) | ✔ | 7 | 48 | 2 | 4.5637 | 5.235 | 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 |
Ca2PbO4 | COD | 2002530 | Pbam (55) | ✔ | 14 | 116 | 1 | 1.7129 | 1.926 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2ZnN2 | COD | 1005002 | I4/mmm (139) | ✔ | 5 | 42 | 1 | 0.7565 | 0.981 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2InN | COD | 1531106 | Cmcm (63) | ✔ | 8 | 76 | 1 | 0.0 | 0.119 | 0.326 | (0;110) | ✗ | 27/01/17 |
Ca2RuH6 | ICSD | 656082 | Fm-3m (225) | ✔ | 9 | 42 | 2 | 2.043 | 2.043 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2MgP2(H2O5)2 | ICSD | 156224 | P-1 (2) | ✔ | 19 | 104 | 2 | 5.6684 | 5.802 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2GeO4 | COD | 1527982 | I4/mmm (139) | ✔ | 7 | 48 | 2 | 3.1506 | 3.559 | 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 |
Ca2FeWO6 | ICSD | 81203 | Fm-3m (225) | ✔ | 10 | 78 | 3 | 0.625 | 0.627 | 0.000 | (0;000) | ✗ | 27/01/17 |