▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
LiPt2 | COD | 4123950 | Fd-3m (227) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.693 | (0;000) | ✗ | 27/01/17 |
YTe2 | ICSD | 653179 | P4/nmm (129) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.663 | (0;000) | ✗ | 27/01/17 |
NaLi3(H2N)4 | ICSD | 201148 | I-4 (82) | ✗ | 16 | 46 | 1 | 3.1757 | 3.289 | 0.000 | (0;000) | ✗ | 15/02/17 |
SiW3 | ICSD | 52476 | Im-3m (229) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.820 | (0;000) | ✗ | 27/01/17 |
CuO2 | ICSD | 54129 | Cmcm (63) | ✔ | 6 | 46 | 1 | 0.0 | 0.000 | 0.927 | (0;110) | ✗ | 02/02/17 |
SbPd | COD | 9008907 | P6_3/mmc (194) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.781 | (1;000) | ✗ | 27/01/17 |
RhSe | ICSD | 52069 | P6_3/mmc (194) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.711 | (0;000) | ✗ | 27/01/17 |
Ag3SI | COD | 1510010 | Pm-3m (221) | ✔ | 5 | 46 | 3 | 0.5828 | 0.818 | 0.000 | (0;000) | ✗ | 30/01/17 |
Sc3In | ICSD | 59523 | Pm-3m (221) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.873 | (1;111) | ✗ | 27/01/17 |
CoO | ICSD | 43458 | P6_3mc (186) | ✗ | 4 | 46 | 3 | 0.0 | 0.000 | 0.929 | ? | ✗ | 15/02/17 |
Zr2NiP | ICSD | 84826 | P2_1/m (11) | ✔ | 8 | 46 | 3 | 0.0 | 0.000 | 0.865 | (0;010) | ✗ | 27/01/17 |
TeIr | COD | 9008897 | P6_3/mmc (194) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.772 | (0;000) | ✗ | 27/01/17 |
VSb2 | COD | 8100157 | I4/mcm (140) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.536 | (1;000) | ✗ | 27/01/17 |
LiMnP | ICSD | 26458 | P4/nmm (129) | ✔ | 6 | 46 | 2 | 0.0 | 0.000 | 0.847 | (0;001) | ✗ | 27/01/17 |
TeRh | COD | 9008916 | P6_3/mmc (194) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.849 | (0;000) | ✗ | 27/01/17 |
LiMnSb | ICSD | 642150 | P4/nmm (129) | ✔ | 6 | 46 | 2 | 0.0 | 0.000 | 0.877 | (1;000) | ✗ | 27/01/17 |
TlNi | COD | 1523258 | P6_3/mmc (194) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.702 | (1;000) | ✗ | 27/01/17 |
NbSb2 | COD | 2310580 | C2/m (12) | ✔ | 6 | 46 | 3 | 0.0 | 0.030 | 0.174 | (0;111) | ✗ | 27/01/17 |
TiNi2Sn | ICSD | 646780 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.009 | 0.217 | (1;000) | ✗ | 27/01/17 |
CuO2 | ICSD | 157553 | Cmcm (63) | ✔ | 6 | 46 | 1 | 0.0 | 0.000 | 0.943 | (0;110) | ✗ | 02/02/17 |
VPt | ICSD | 649832 | Pmma (51) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.821 | (0;101) | ✗ | 27/01/17 |
RbN3 | ICSD | 34273 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 4.3028 | 4.303 | 0.000 | (0;000) | ✗ | 27/01/17 |
Rb2PdSe2 | ICSD | 648724 | Immm (71) | ✔ | 5 | 48 | 1 | 0.9267 | 1.384 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaH2 | ICSD | 615909 | Pnma (62) | ✔ | 12 | 48 | 1 | 2.9001 | 3.374 | 0.000 | (0;000) | ✗ | 02/02/17 |
KAlTe2 | ICSD | 44703 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 1.5093 | 1.811 | 0.000 | (0;000) | ✗ | 30/01/17 |
K2S | ICSD | 27461 | P6_3/mmc (194) | ✔ | 6 | 48 | 1 | 1.076 | 1.076 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrNiP2 | ICSD | 646193 | P4/nmm (129) | ✔ | 8 | 48 | 2 | 0.0 | 0.001 | 0.336 | (1;000) | ✗ | 27/01/17 |
PdO | COD | 1009031 | P4_2/mmc (131) | ✔ | 4 | 48 | 3 | 0.0 | 0.018 | 0.125 | (0;000) | ✗ | 27/01/17 |
TiO2 | COD | 9007432 | P4_2/mnm (136) | ✔ | 6 | 48 | 3 | 1.9813 | 1.981 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbSrCO3F | ICSD | 262233 | P-6m2 (187) | ✗ | 7 | 48 | 1 | 4.2648 | 4.268 | 0.000 | (0;000) | ✗ | 15/02/17 |
H4CN2O | COD | 1008786 | P-42_1m (113) | ✗ | 16 | 48 | 1 | 5.1355 | 5.136 | 0.000 | (0;000) | ✗ | 15/02/17 |
RbBi | ICSD | 9787 | Pmmn (59) | ✔ | 4 | 48 | 1 | 0.0 | 0.002 | 0.246 | (0;000) | ✗ | 02/02/17 |
Zr2SeN2 | ICSD | 424266 | P6_3/mmc (194) | ✔ | 10 | 48 | 3 | 0.0 | 1.360 | 0.034 | (0;000) | ✗ | 27/01/17 |
Li2GePbS4 | ICSD | 281011 | I-42m (121) | ✗ | 8 | 48 | 2 | 1.4519 | 1.524 | 0.000 | (0;000) | ✗ | 15/02/17 |
Mg(BH4)2 | ICSD | 262083 | P4_2nm (102) | ✗ | 22 | 48 | 3 | 5.5084 | 5.786 | 0.000 | (0;000) | ✗ | 04/08/17 |
MgW | COD | 9015083 | Pmma (51) | ✔ | 4 | 48 | 1 | 0.0 | 0.094 | 0.191 | (0;000) | ✗ | 27/01/17 |
NaAlTe2 | ICSD | 44701 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 1.3954 | 1.477 | 0.000 | (0;000) | ✗ | 30/01/17 |
Mg2Si | ICSD | 108584 | Fd-3m (227) | ✔ | 6 | 48 | 3 | 0.0 | 0.468 | 0.440 | (0;000) | ✗ | 27/01/17 |
Na2S | COD | 2106221 | P6_3/mmc (194) | ✔ | 6 | 48 | 1 | 2.4792 | 2.479 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiZn3 | COD | 1527931 | Pm-3m (221) | ✔ | 4 | 48 | 3 | 0.0 | 0.000 | 0.713 | (1;111) | ✗ | 27/01/17 |
Fe3S4 | ICSD | 44885 | R3m (160) | ✗ | 7 | 48 | 2 | 0.0 | 0.008 | 0.769 | ? | ✗ | 15/02/17 |
KCaCO3F | COD | 2203515 | P-6m2 (187) | ✗ | 7 | 48 | 1 | 4.4344 | 4.439 | 0.000 | (0;000) | ✗ | 15/02/17 |
PtPb | COD | 1522617 | P6_3/mmc (194) | ✔ | 4 | 48 | 3 | 0.0 | 0.032 | 0.702 | (0;000) | ✗ | 27/01/17 |
Cs2S | ICSD | 27463 | P6_3/mmc (194) | ✔ | 6 | 48 | 1 | 1.3455 | 1.346 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbNaS | COD | 9007814 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 2.3693 | 2.442 | 0.000 | (0;000) | ✗ | 27/01/17 |
TePd | COD | 9008909 | P6_3/mmc (194) | ✔ | 4 | 48 | 3 | 0.0 | 0.000 | 0.424 | (0;000) | ✗ | 27/01/17 |
Ge2Te5As2 | ICSD | 68112 | P-3m1 (164) | ✔ | 9 | 48 | 2 | 0.1138 | 0.188 | 0.000 | (0;000) | ✗ | 30/01/17 |
LiCN | COD | 9008984 | Pnma (62) | ✔ | 12 | 48 | 1 | 5.7574 | 5.757 | 0.000 | (0;000) | ✗ | 02/02/17 |
ReNCl4 | COD | 7221223 | P1 (1) | ✗ | 6 | 48 | 1 | 1.2934 | 1.382 | 0.000 | (0;000) | ✗ | 22/03/17 |
MoPt | ICSD | 644160 | Pmma (51) | ✔ | 4 | 48 | 3 | 0.0 | 0.065 | 0.516 | (0;101) | ✗ | 27/01/17 |