▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Nb2CS2 | COD | 1532142 | P-3m1 (164) | ✔ | 5 | 42 | 2 | 0.0 | 0.034 | 0.307 | (1;001) | ✗ | 27/01/17 |
Nb2CS2 | COD | 1532143 | R-3m (166) | ✔ | 5 | 42 | 2 | 0.0 | 0.017 | 0.340 | (0;111) | ✗ | 27/01/17 |
ZrTiF6 | COD | 1532187 | Fm-3m (225) | ✔ | 8 | 58 | 3 | 0.0 | 0.000 | 0.676 | (0;000) | ✗ | 27/01/17 |
Ca2SiIr2 | COD | 1532211 | C2/c (15) | ✔ | 10 | 116 | 3 | 0.0 | 0.096 | 0.412 | (0;110) | ✗ | 02/02/17 |
Cs2PdCl4 | COD | 1532214 | Cmcm (63) | ✔ | 14 | 128 | 1 | 1.6548 | 1.655 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2PdCl4 | COD | 1532216 | P4/mmm (123) | ✔ | 7 | 64 | 1 | 1.6208 | 1.621 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsMnBr3 | COD | 1532232 | P6_3/mmc (194) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.764 | (0;000) | ✗ | 02/02/17 |
RbMnBr3 | COD | 1532234 | P6_3/mmc (194) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.748 | (0;000) | ✗ | 02/02/17 |
CsBF4 | COD | 1532247 | Pnma (62) | ✔ | 24 | 160 | 1 | 7.8917 | 7.931 | 0.000 | (0;000) | ✗ | 04/08/17 |
Rb3CoO2 | COD | 1532295 | Pnma (62) | ✔ | 24 | 224 | 1 | 0.0 | 0.003 | 0.119 | (1;000) | ✗ | 04/08/17 |
SrCu2O3 | COD | 1532418 | Pmmn (59) | ✔ | 12 | 100 | 3 | 0.0 | 0.002 | 0.729 | (0;000) | ✗ | 27/01/17 |
Li4SiO4 | COD | 1532523 | P-1 (2) | ✔ | 18 | 80 | 1 | 4.9579 | 5.193 | 0.000 | (0;000) | ✗ | 27/01/17 |
Hf(MoO4)2 | COD | 1532569 | C2/c (15) | ✔ | 22 | 176 | 3 | 2.8462 | 2.846 | 0.000 | (0;000) | ✗ | 07/08/17 |
Li3AlH6 | COD | 1532615 | R-3 (148) | ✔ | 20 | 36 | 2 | 3.6166 | 3.945 | 0.000 | (0;000) | ✗ | 05/01/17 |
KAlH4 | COD | 1532616 | Pnma (62) | ✔ | 24 | 64 | 1 | 5.0402 | 5.300 | 0.000 | (0;000) | ✗ | 04/08/17 |
KH4F5 | COD | 1532621 | I4_1/a (88) | ✔ | 20 | 96 | 1 | 5.6134 | 5.613 | 0.000 | (0;000) | ✗ | 02/02/17 |
TiSnSb | COD | 1532679 | Fddd (70) | ✔ | 12 | 124 | 3 | 0.0 | 0.001 | 0.667 | (1;111) | ✗ | 02/02/17 |
NbBiO4 | COD | 1532718 | Pnna (52) | ✔ | 24 | 208 | 3 | 2.8013 | 2.921 | 0.000 | (0;000) | ✗ | 04/08/17 |
TaBiO4 | COD | 1532721 | Pnna (52) | ✔ | 24 | 208 | 3 | 2.9069 | 2.907 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba(AlGe)2 | COD | 1532737 | Pnma (62) | ✔ | 20 | 96 | 3 | 0.0 | 0.004 | 0.120 | (0;000) | ✗ | 30/01/17 |
K3Zn2F7 | COD | 1532738 | I4/mmm (139) | ✔ | 12 | 100 | 2 | 4.0551 | 5.518 | 0.000 | (0;000) | ✗ | 22/03/17 |
Ba(AlGe)2 | COD | 1532740 | I4/mmm (139) | ✔ | 5 | 24 | 2 | 0.0 | 0.028 | 0.264 | (0;000) | ✗ | 05/01/17 |
BaZrO3 | COD | 1532743 | Pm-3m (221) | ✔ | 5 | 32 | 3 | 2.7993 | 2.799 | 0.000 | (0;000) | ✗ | 05/01/17 |
CaZrO3 | COD | 1532747 | Pnma (62) | ✔ | 20 | 128 | 3 | 3.4975 | 3.498 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiHS | COD | 1532751 | P4_2/mbc (135) | ✔ | 24 | 80 | 1 | 3.5998 | 3.600 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiHS | COD | 1532755 | Pmc2_1 (26) | ✗ | 12 | 40 | 1 | 3.5171 | 3.517 | 0.000 | (0;000) | ✗ | 15/02/17 |
MoPRu | COD | 1532784 | Pnma (62) | ✔ | 12 | 140 | 3 | 0.0 | 0.000 | 0.713 | (0;011) | ✗ | 27/01/17 |
Y2Pd2Pb | COD | 1532869 | P4/mbm (127) | ✔ | 10 | 144 | 3 | 0.0 | 0.006 | 0.632 | (0;000) | ✗ | 02/02/17 |
Na2RuO3 | COD | 1532912 | C2/c (15) | ✔ | 24 | 208 | 3 | 0.0 | 0.023 | 0.366 | (0;000) | ✗ | 04/08/17 |
YAlSi | COD | 1533018 | Cmcm (63) | ✔ | 6 | 36 | 3 | 0.0 | 0.015 | 0.313 | (0;110) | ✗ | 05/01/17 |
CaTiF6 | COD | 1533036 | R-3m (166) | ✔ | 8 | 64 | 3 | 3.9477 | 3.948 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ni2SbTe2 | COD | 1533053 | P6_3/mmc (194) | ✔ | 10 | 74 | 2 | 0.0 | 0.000 | 0.889 | (0;000) | ✗ | 02/02/17 |
YAlO3 | COD | 1533069 | Pnma (62) | ✔ | 20 | 128 | 3 | 5.6486 | 5.665 | 0.000 | (0;000) | ✗ | 30/01/17 |
CsGaSe3 | COD | 1533091 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 1.9338 | 2.031 | 0.000 | (0;000) | ✗ | 02/02/17 |
SbClF8 | COD | 1533112 | P-1 (2) | ✔ | 20 | 136 | 1 | 3.0697 | 3.115 | 0.000 | (0;000) | ✗ | 02/02/17 |
SbAsF8 | COD | 1533113 | P2_1/m (11) | ✔ | 20 | 132 | 1 | 4.5459 | 4.676 | 0.000 | (0;000) | ✗ | 30/01/17 |
MnSeO3 | COD | 1533149 | Pnma (62) | ✔ | 20 | 156 | 3 | 0.0 | 0.001 | 0.434 | (0;110) | ✗ | 02/02/17 |
Rb2CrCl4 | COD | 1533153 | I4/mmm (139) | ✔ | 7 | 60 | 1 | 0.0 | 0.008 | 0.180 | (1;111) | ✗ | 02/02/17 |
Ba3CrS5 | COD | 1533192 | P6_3cm (185) | ✗ | 18 | 148 | 1 | 0.0 | 0.000 | 0.838 | ? | ✗ | 21/03/17 |
Ba3(CrS3)2 | COD | 1533193 | R-3c (167) | ✔ | 22 | 188 | 1 | 0.0 | 0.005 | 0.126 | (1;000) | ✗ | 07/08/17 |
Li4ZrGe2 | COD | 1533277 | R-3m (166) | ✔ | 7 | 24 | 1 | 0.0 | 0.008 | 0.572 | (1;000) | ✗ | 27/01/17 |
Ca3Mn2O7 | COD | 1533328 | I4/mmm (139) | ✔ | 12 | 102 | 3 | 0.0 | 0.007 | 0.968 | (0;000) | ✗ | 21/03/17 |
TeI | COD | 2000148 | P-1 (2) | ✔ | 16 | 104 | 1 | 0.7663 | 0.767 | 0.000 | (0;000) | ✗ | 02/02/17 |
CN | COD | 2000225 | C2/c (15) | ✔ | 24 | 108 | 1 | 0.0 | 0.002 | 0.461 | (0;110) | ✗ | 04/08/17 |
BiMoO2 | COD | 2000338 | I4_1/a (88) | ✔ | 16 | 164 | 3 | 0.0 | 0.023 | 0.324 | (1;111) | ✗ | 21/03/17 |
HIO3 | COD | 2000582 | P2_12_12_1 (19) | ✗ | 20 | 104 | 3 | 3.1754 | 3.229 | 0.000 | (0;000) | ✗ | 29/03/17 |
SrBiO3 | COD | 2000656 | Cmcm (63) | ✔ | 10 | 86 | 1 | 0.0 | 0.000 | 0.951 | (1;110) | ✗ | 05/01/17 |
LiInF4 | COD | 2000863 | Pbcn (60) | ✔ | 24 | 176 | 2 | 4.4823 | 4.482 | 0.000 | (0;000) | ✗ | 04/08/17 |
BaSi2CuO6 | COD | 2001087 | I4/mmm (139) | ✔ | 20 | 130 | 2 | 0.0 | 0.003 | 0.025 | (0;111) | ✗ | 02/02/17 |
C3S8 | COD | 2001128 | P-1 (2) | ✔ | 22 | 120 | 1 | 1.5344 | 1.628 | 0.000 | (0;000) | ✗ | 04/08/17 |