▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Al2Pd | ICSD | 58116 | Fm-3m (225) | ✔ | 3 | 24 | 3 | 0.0 | 0.018 | 0.855 | (0;000) | ✗ | 05/01/17 |
Mg(AlSi)2 | ICSD | 156101 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 0.0 | 0.735 | 0.315 | (0;000) | ✗ | 05/01/17 |
WN2 | ICSD | 30364 | R-3m (166) | ✔ | 3 | 24 | 2 | 0.0 | 0.002 | 0.186 | (1;000) | ✗ | 27/01/17 |
Rb2Se | ICSD | 168449 | Fm-3m (225) | ✔ | 3 | 24 | 1 | 1.8007 | 2.127 | 0.000 | (0;000) | ✗ | 27/01/17 |
MgBr2 | COD | 9009107 | P-3m1 (164) | ✔ | 3 | 24 | 2 | 4.1115 | 4.112 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2S | COD | 9009068 | Fm-3m (225) | ✔ | 3 | 24 | 1 | 2.1158 | 2.527 | 0.000 | (0;000) | ✗ | 27/01/17 |
HgO2 | ICSD | 48214 | C2/m (12) | ✔ | 3 | 24 | 3 | 0.8828 | 1.430 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr(AlGe)2 | ICSD | 608014 | P-3m1 (164) | ✔ | 5 | 24 | 2 | 0.0 | 0.016 | 0.167 | (0;000) | ✗ | 05/01/17 |
Mg(AlH4)2 | ICSD | 152538 | P-3m1 (164) | ✔ | 11 | 24 | 3 | 4.2588 | 4.779 | 0.000 | (0;000) | ✗ | 05/01/17 |
ZrGe2 | COD | 2310672 | Cmcm (63) | ✔ | 6 | 24 | 3 | 0.0 | 0.008 | 0.223 | (1;110) | ✗ | 27/01/17 |
Zr | ICSD | 31668 | C2/c (15) | ✔ | 6 | 24 | 1 | 0.0 | 0.022 | 0.320 | (0;000) | ✗ | 02/02/17 |
CuH | ICSD | 44859 | P6_3mc (186) | ✗ | 4 | 24 | 3 | 0.5757 | 1.488 | 0.000 | (0;000) | ✗ | 06/10/16 |
Li3Bi | ICSD | 58797 | Fm-3m (225) | ✔ | 4 | 24 | 1 | 0.0 | 0.403 | 0.105 | (0;000) | ✗ | 05/01/17 |
NaN3 | ICSD | 29383 | C2/m (12) | ✔ | 4 | 24 | 1 | 0.0 | 0.008 | 0.483 | (0;110) | ✗ | 27/01/17 |
Li4ZrGe2 | COD | 1533277 | R-3m (166) | ✔ | 7 | 24 | 1 | 0.0 | 0.008 | 0.572 | (1;000) | ✗ | 27/01/17 |
Ba(AlSi)2 | ICSD | 153385 | I4/mmm (139) | ✔ | 5 | 24 | 2 | 0.0 | 0.000 | 0.319 | (1;000) | ✗ | 05/01/17 |
Li4NCl | ICSD | 84649 | R-3m (166) | ✔ | 6 | 24 | 1 | 1.8222 | 1.875 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca(AlGe)2 | COD | 8101147 | P-3m1 (164) | ✔ | 5 | 24 | 2 | 0.0 | 0.134 | 0.202 | (0;000) | ✗ | 05/01/17 |
BaH2 | ICSD | 615913 | Cmcm (63) | ✔ | 6 | 24 | 1 | 1.7224 | 2.854 | 0.000 | (0;000) | ✗ | 02/02/17 |
La2O3 | ICSD | 56166 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 3.0056 | 3.250 | 0.000 | (0;000) | ✗ | 06/10/16 |
NaBi | ICSD | 616837 | P4/mmm (123) | ✔ | 2 | 24 | 2 | 0.0 | 0.099 | 0.424 | (1;000) | ✗ | 05/01/17 |
SiPt2 | ICSD | 77973 | I4/mmm (139) | ✔ | 3 | 24 | 3 | 0.0 | 0.138 | 0.700 | (0;000) | ✗ | 27/01/17 |
YIn | ICSD | 188185 | Pm-3m (221) | ✔ | 2 | 24 | 3 | 0.0 | 0.000 | 0.449 | (0;000) | ✗ | 27/01/17 |
LiB | ICSD | 236961 | Pbmm (51) | ✔ | 8 | 24 | 2 | 0.0 | 0.004 | 0.395 | (0;001) | ✗ | 06/10/16 |
Ca(AlSi)2 | COD | 1529999 | P-3m1 (164) | ✔ | 5 | 24 | 2 | 0.0 | 0.524 | 0.208 | (0;000) | ✗ | 05/01/17 |
Ba(AlGe)2 | COD | 1532740 | I4/mmm (139) | ✔ | 5 | 24 | 2 | 0.0 | 0.028 | 0.264 | (0;000) | ✗ | 05/01/17 |
Rb2O | COD | 9009067 | Fm-3m (225) | ✔ | 3 | 24 | 3 | 1.4925 | 2.158 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaF2 | COD | 9009004 | Fm-3m (225) | ✔ | 3 | 24 | 1 | 6.7708 | 6.829 | 0.000 | (0;000) | ✗ | 05/01/17 |
PdO | ICSD | 77650 | Fm-3m (225) | ✔ | 2 | 24 | 1 | 0.0 | 0.000 | 0.599 | (0;000) | ✗ | 27/01/17 |
BH3 | ICSD | 15598 | P2_1/c (14) | ✔ | 16 | 24 | 1 | 5.9279 | 5.928 | 0.000 | (0;000) | ✗ | 05/01/17 |
MgF2 | ICSD | 51242 | Cm2m (38) | ✗ | 3 | 24 | 1 | 0.86 | 0.994 | 0.000 | (0;000) | ✗ | 06/10/16 |
NaN3 | COD | 1010392 | R-3m (166) | ✔ | 4 | 24 | 1 | 4.3404 | 4.749 | 0.000 | (0;000) | ✗ | 27/01/17 |
PdO | COD | 1011329 | P4/mmm (123) | ✔ | 2 | 24 | 2 | 0.0 | 0.009 | 0.422 | (0;110) | ✗ | 27/01/17 |
ZnCl2 | COD | 9009136 | R-3m (166) | ✔ | 3 | 26 | 2 | 3.1235 | 3.189 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiCl2 | COD | 9009121 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.0 | 0.003 | 0.554 | (0;000) | ✗ | 27/01/17 |
FeN | COD | 1524693 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.679 | (0;000) | ✗ | 27/01/17 |
LiYS2 | ICSD | 44957 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.6757 | 2.755 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiYSe2 | ICSD | 44963 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.0914 | 2.359 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2HN | COD | 4030485 | R-3m (166) | ✔ | 4 | 26 | 1 | 1.046 | 1.336 | 0.000 | (0;000) | ✗ | 05/01/17 |
TiF2 | ICSD | 65410 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 0.0 | 0.000 | 0.347 | (0;000) | ✗ | 27/01/17 |
ZrCl2 | ICSD | 20144 | R3m (160) | ✗ | 3 | 26 | 2 | 0.8387 | 1.424 | 0.000 | (0;000) | ✗ | 06/10/16 |
WS2 | ICSD | 202367 | R3m (160) | ✗ | 3 | 26 | 2 | 0.8802 | 1.635 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiScS2 | ICSD | 642305 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.5243 | 2.409 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2LiN | COD | 1526569 | P6/mmm (191) | ✔ | 4 | 26 | 2 | 0.0 | 0.012 | 0.037 | (1;000) | ✗ | 27/01/17 |
PbO2 | COD | 9005762 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 0.0 | 0.000 | 0.084 | (1;000) | ✗ | 27/01/17 |
LiNO3 | COD | 1011340 | R-3m (166) | ✔ | 5 | 26 | 3 | 0.0 | 0.012 | 0.680 | (1;111) | ✗ | 27/01/17 |
CdF2 | COD | 9009006 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 3.0777 | 3.498 | 0.000 | (0;000) | ✗ | 27/01/17 |
Tl | COD | 9008518 | P6_3/mmc (194) | ✔ | 2 | 26 | 3 | 0.0 | 0.000 | 0.516 | (0;000) | ✗ | 27/01/17 |
LiCuO2 | ICSD | 74978 | C2/m (12) | ✔ | 4 | 26 | 2 | 0.4034 | 0.819 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sb3Au | COD | 1510290 | Im-3m (229) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.613 | (1;000) | ✗ | 05/01/17 |