▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BCl | COD | 9008995 | P4_2/nmc (137) | ✔ | 16 | 80 | 2 | 3.0503 | 3.056 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cr5Si3B | ICSD | 613552 | P6_3/mcm (193) | ✔ | 18 | 170 | 3 | 0.0 | 0.000 | 0.921 | (0;000) | ✗ | 02/02/17 |
Cs3BP2 | COD | 8103455 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.8676 | 1.908 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsNa2BO3 | ICSD | 67524 | Pmmn (59) | ✔ | 14 | 96 | 1 | 3.5967 | 3.648 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsBSe3 | COD | 1511083 | P2_1/c (14) | ✔ | 20 | 120 | 1 | 1.7859 | 1.948 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb3NaBe2F8 | COD | 1008068 | P-3m1 (164) | ✔ | 14 | 100 | 1 | 6.6979 | 6.755 | 0.000 | (0;000) | ✗ | 02/02/17 |
Be2Ru | ICSD | 616410 | P6_3/mmc (194) | ✔ | 12 | 96 | 1 | 0.0 | 0.003 | 0.511 | (0;000) | ✗ | 02/02/17 |
Bi | ICSD | 187502 | Cmce (64) | ✔ | 8 | 120 | 3 | 0.0 | 0.028 | 0.332 | (0;000) | ✗ | 02/02/17 |
CsBeH3 | COD | 4343938 | P2_1/m (11) | ✔ | 10 | 32 | 1 | 3.2267 | 3.555 | 0.000 | (0;000) | ✗ | 02/02/17 |
KBeH3 | COD | 4343937 | P2_1/c (14) | ✔ | 20 | 64 | 1 | 3.2474 | 3.247 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbBeH3 | COD | 4343941 | P2_1/c (14) | ✔ | 20 | 64 | 1 | 3.2803 | 3.280 | 0.000 | (0;000) | ✗ | 02/02/17 |
BeI2 | COD | 1526852 | Ibam (72) | ✔ | 6 | 36 | 1 | 3.5201 | 3.752 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2BeO2 | ICSD | 23633 | P2_1/c (14) | ✔ | 20 | 136 | 3 | 3.1261 | 3.253 | 0.000 | (0;000) | ✗ | 02/02/17 |
K4BeP2 | ICSD | 300110 | R-3m (166) | ✔ | 7 | 50 | 1 | 1.1639 | 1.189 | 0.000 | (0;000) | ✗ | 02/02/17 |
BeSO8 | COD | 9014047 | I4/mcm (140) | ✔ | 20 | 116 | 1 | 0.0 | 0.002 | 0.475 | (1;000) | ✗ | 02/02/17 |
Mg3B(OF)3 | COD | 9009572 | P6_3/m (176) | ✔ | 20 | 144 | 3 | 5.6931 | 5.716 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb5Ge2B | ICSD | 614401 | I4/mcm (140) | ✔ | 16 | 152 | 3 | 0.0 | 0.007 | 0.332 | (1;111) | ✗ | 02/02/17 |
Nb5Ge3B | ICSD | 614400 | P6_3/mcm (193) | ✔ | 18 | 160 | 3 | 0.0 | 0.013 | 0.619 | (1;000) | ✗ | 02/02/17 |
Ta5Ge3B | ICSD | 614404 | P6_3/mcm (193) | ✔ | 18 | 160 | 3 | 0.0 | 0.003 | 0.571 | (1;000) | ✗ | 02/02/17 |
V5Ge3B | ICSD | 614407 | P6_3/mcm (193) | ✔ | 18 | 160 | 3 | 0.0 | 0.012 | 0.420 | (1;000) | ✗ | 02/02/17 |
Cs3Bi2Br9 | COD | 2106376 | P-3m1 (164) | ✔ | 14 | 120 | 2 | 1.7199 | 1.866 | 0.000 | (0;000) | ✗ | 02/02/17 |
InBi2Se4Br | ICSD | 159465 | C2/m (12) | ✔ | 16 | 148 | 3 | 0.9314 | 0.934 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaMnBi2 | COD | 7221108 | P4/nmm (129) | ✔ | 8 | 110 | 1 | 0.0 | 0.000 | 0.864 | (0;000) | ✗ | 02/02/17 |
TlBi2Cl7 | ICSD | 421318 | P-1 (2) | ✔ | 20 | 184 | 3 | 2.7397 | 2.804 | 0.000 | (0;000) | ✗ | 02/02/17 |
Hg3Bi2(SCl4)2 | ICSD | 237618 | C2/m (12) | ✔ | 15 | 134 | 3 | 2.5966 | 2.597 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ti4CoBi2 | ICSD | 150147 | I4/mcm (140) | ✔ | 14 | 190 | 3 | 0.0 | 0.000 | 0.920 | (1;111) | ✗ | 02/02/17 |
Cs2NiBi2 | ICSD | 658704 | Cmcm (63) | ✔ | 10 | 116 | 3 | 0.3142 | 0.314 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Bi2Pd | ICSD | 658703 | Cmcm (63) | ✔ | 10 | 132 | 3 | 0.4422 | 0.496 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Bi2Pt | ICSD | 658701 | Cmcm (63) | ✔ | 10 | 116 | 3 | 0.6288 | 0.810 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs3Bi2 | COD | 4116198 | C2/c (15) | ✔ | 10 | 114 | 1 | 0.0 | 0.000 | 0.262 | (0;011) | ✗ | 02/02/17 |
CsBi2 | ICSD | 58771 | Fd-3m (227) | ✔ | 6 | 78 | 3 | 0.0 | 0.000 | 0.599 | (0;000) | ✗ | 02/02/17 |
Ge(BiTe2)2 | ICSD | 30394 | R-3m (166) | ✔ | 7 | 58 | 3 | 0.0 | 0.174 | 0.007 | (1;111) | ✗ | 02/02/17 |
Hg(BiS2)2 | COD | 9011213 | C2/m (12) | ✔ | 14 | 132 | 3 | 0.756 | 0.765 | 0.000 | (0;000) | ✗ | 02/02/17 |
Bi2Ir | ICSD | 616739 | P2_1/c (14) | ✔ | 12 | 188 | 3 | 0.0 | 0.154 | 0.167 | (0;000) | ✗ | 02/02/17 |
Mg(BiO3)2 | ICSD | 50005 | P4_2/mnm (136) | ✔ | 18 | 152 | 3 | 0.0 | 0.008 | 0.035 | (0;000) | ✗ | 02/02/17 |
MnNi(BiO3)2 | ICSD | 153857 | P2_1/c (14) | ✔ | 20 | 182 | 3 | 0.0 | 0.000 | 0.877 | (0;000) | ✗ | 02/02/17 |
Mn(BiSe2)2 | ICSD | 603311 | C2/m (12) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.138 | (0;110) | ✗ | 02/02/17 |
Ti4MnBi2 | ICSD | 150145 | I4/mcm (140) | ✔ | 14 | 186 | 3 | 0.0 | 0.000 | 0.573 | (1;111) | ✗ | 02/02/17 |
Bi2MoO6 | ICSD | 37251 | Cmce (64) | ✔ | 18 | 160 | 3 | 0.3995 | 0.401 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ni3(BiSe)2 | COD | 1524228 | C2/m (12) | ✔ | 14 | 144 | 3 | 0.0 | 0.013 | 0.816 | (1;111) | ✗ | 02/02/17 |
Ti4NiBi2 | ICSD | 150148 | I4/mcm (140) | ✔ | 14 | 176 | 3 | 0.0 | 0.001 | 0.464 | (0;000) | ✗ | 02/02/17 |
Bi2O3 | COD | 1010004 | P2_1/c (14) | ✔ | 20 | 192 | 3 | 0.0 | 0.077 | 0.116 | (1;000) | ✗ | 02/02/17 |
Bi2O3 | COD | 4332559 | Pccn (56) | ✔ | 20 | 192 | 3 | 2.313 | 2.314 | 0.000 | (0;000) | ✗ | 02/02/17 |
Bi2O3 | COD | 9012546 | P2_1/c (14) | ✔ | 20 | 192 | 3 | 2.2166 | 2.249 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr(BiO2)2 | ICSD | 80668 | C2/m (12) | ✔ | 14 | 128 | 1 | 0.3368 | 0.827 | 0.000 | (0;000) | ✗ | 02/02/17 |
Bi2TeO6 | ICSD | 6239 | Cmce (64) | ✔ | 18 | 144 | 3 | 1.7449 | 1.745 | 0.000 | (0;000) | ✗ | 02/02/17 |
Bi2Pb2Se5 | ICSD | 30372 | P-3m1 (164) | ✔ | 9 | 88 | 3 | 0.0977 | 0.215 | 0.000 | (1;000) | ✗ | 02/02/17 |
Bi2Te5Pb2 | ICSD | 42708 | P-3m1 (164) | ✔ | 9 | 88 | 3 | 0.0 | 0.002 | 0.115 | (1;000) | ✗ | 02/02/17 |
Bi2Te4Pb | ICSD | 616936 | R-3m (166) | ✔ | 7 | 68 | 3 | 0.0449 | 0.134 | 0.000 | (1;111) | ✗ | 02/02/17 |
Sr(BiPd)2 | ICSD | 604338 | P4/nmm (129) | ✔ | 10 | 152 | 3 | 0.0 | 0.010 | 0.832 | (0;000) | ✗ | 02/02/17 |