▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▴ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TePb2O5 | COD | 9015570 | C2/c (15) | ✔ | 16 | 128 | 3 | 2.1428 | 2.356 | 0.000 | (0;000) | ✗ | 02/02/17 |
TiNb3O6 | ICSD | 280002 | R-3 (148) | ✔ | 20 | 174 | 3 | 0.5492 | 0.739 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2RbBiF6 | ICSD | 9384 | Fm-3m (225) | ✔ | 10 | 84 | 3 | 4.0212 | 4.051 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbCu3S2 | COD | 8100809 | C2/m (12) | ✔ | 12 | 108 | 1 | 0.4589 | 0.459 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsKC2 | ICSD | 189822 | Pnma (62) | ✔ | 16 | 104 | 1 | 3.2247 | 3.231 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2NiAs2 | ICSD | 300120 | Cmcm (63) | ✔ | 10 | 76 | 1 | 0.1072 | 0.117 | 0.000 | (0;000) | ✗ | 30/01/17 |
BaBr2 | COD | 1527183 | Pnma (62) | ✔ | 12 | 96 | 1 | 4.134 | 4.134 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs3Bi | ICSD | 659568 | Fm-3m (225) | ✔ | 4 | 42 | 1 | 0.1791 | 0.627 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaTe2 | ICSD | 80280 | I4/mcm (140) | ✔ | 6 | 44 | 1 | 0.3666 | 1.130 | 0.000 | (0;000) | ✗ | 02/02/17 |
CuSe3Br | COD | 1524480 | Pmna (53) | ✔ | 20 | 144 | 3 | 0.8867 | 1.006 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y6PdBr10 | ICSD | 424467 | P-1 (2) | ✔ | 17 | 154 | 3 | 0.498 | 0.589 | 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 |
K2TeBr6 | ICSD | 37270 | P4/mnc (128) | ✔ | 18 | 132 | 1 | 1.6962 | 1.875 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaAlTe2 | ICSD | 44701 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 1.3954 | 1.477 | 0.000 | (0;000) | ✗ | 30/01/17 |
NbSeCl3 | COD | 2209086 | P2/c (13) | ✔ | 20 | 160 | 1 | 0.7005 | 0.816 | 0.000 | (0;000) | ✗ | 02/02/17 |
AgPS3 | COD | 2105351 | C2/m (12) | ✔ | 10 | 68 | 3 | 1.3659 | 1.686 | 0.000 | (0;000) | ✗ | 30/01/17 |
Hg2PCl2 | ICSD | 50594 | C2/m (12) | ✔ | 10 | 86 | 3 | 1.5841 | 2.163 | 0.000 | (0;000) | ✗ | 02/02/17 |
Hg2As3Br | ICSD | 75169 | C2/c (15) | ✔ | 12 | 92 | 3 | 0.9002 | 1.173 | 0.000 | (0;000) | ✗ | 30/01/17 |
CsCd4As3 | COD | 4326065 | P4/mmm (123) | ✔ | 8 | 72 | 2 | 0.2198 | 0.220 | 0.000 | (0;000) | ✗ | 30/01/17 |
Na3AlP2 | ICSD | 73278 | Ibam (72) | ✔ | 12 | 80 | 1 | 1.3748 | 1.578 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ba(CO)4 | ICSD | 412830 | I4/mcm (140) | ✔ | 18 | 100 | 1 | 2.5686 | 2.652 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2GeCl6 | COD | 1010389 | Fm-3m (225) | ✔ | 9 | 64 | 1 | 1.8603 | 1.860 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaIF | COD | 9011175 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 3.635 | 3.635 | 0.000 | (0;000) | ✗ | 30/01/17 |
BaYAgTe3 | ICSD | 88717 | Cmcm (63) | ✔ | 12 | 100 | 1 | 0.4318 | 0.783 | 0.000 | (0;000) | ✗ | 30/01/17 |
Zr2ZnAg2F14 | ICSD | 422839 | C2/m (12) | ✔ | 19 | 140 | 3 | 0.2533 | 0.686 | 0.000 | (0;000) | ✗ | 30/01/17 |
SbSI | ICSD | 28305 | Pnma (62) | ✔ | 12 | 72 | 1 | 1.329 | 1.450 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2CdO2 | ICSD | 25004 | Pbcn (60) | ✔ | 20 | 168 | 2 | 1.4489 | 1.475 | 0.000 | (0;000) | ✗ | 02/02/17 |
Pt(SCl3)2 | ICSD | 66013 | P-1 (2) | ✔ | 9 | 64 | 1 | 1.6439 | 1.676 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3AgS2 | COD | 1509476 | Ibam (72) | ✔ | 12 | 100 | 1 | 2.2573 | 2.527 | 0.000 | (0;000) | ✗ | 30/01/17 |
BeI2 | COD | 1526852 | Ibam (72) | ✔ | 6 | 36 | 1 | 3.5201 | 3.752 | 0.000 | (0;000) | ✗ | 02/02/17 |
HCCl2 | COD | 7106717 | P2_1/c (14) | ✔ | 16 | 76 | 1 | 5.0857 | 5.162 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbCuPdSe5 | COD | 4313763 | P2_1/m (11) | ✔ | 16 | 136 | 1 | 1.0871 | 1.125 | 0.000 | (0;000) | ✗ | 02/02/17 |
KZrCuSe3 | ICSD | 80625 | Cmcm (63) | ✔ | 12 | 84 | 2 | 0.1374 | 0.137 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2Ni3Se4 | ICSD | 641277 | Fddd (70) | ✔ | 18 | 144 | 1 | 0.3535 | 0.461 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2Cu2SnS4 | ICSD | 74020 | Ibam (72) | ✔ | 18 | 156 | 2 | 1.1287 | 1.160 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr(GaS2)2 | ICSD | 635274 | Cccm (66) | ✔ | 14 | 120 | 1 | 2.7389 | 2.819 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2AgP | COD | 8103396 | Cmcm (63) | ✔ | 8 | 68 | 1 | 1.1954 | 1.279 | 0.000 | (0;000) | ✗ | 30/01/17 |
KCO2 | COD | 4313233 | Pbam (55) | ✔ | 16 | 100 | 1 | 2.8207 | 2.821 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba2Li3NbN4 | ICSD | 75516 | C2/c (15) | ✔ | 20 | 124 | 1 | 2.4675 | 2.594 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiCaAlN2 | ICSD | 424911 | P2_1/c (14) | ✔ | 20 | 104 | 1 | 2.8043 | 2.811 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ba3InSe4Cl | ICSD | 250812 | I4/mcm (140) | ✔ | 18 | 148 | 3 | 2.301 | 2.403 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2TlBiF6 | ICSD | 9385 | Fm-3m (225) | ✔ | 10 | 88 | 3 | 1.7247 | 1.725 | 0.000 | (0;000) | ✗ | 02/02/17 |
Al2HgSe4 | ICSD | 608163 | Fd-3m (227) | ✔ | 14 | 84 | 3 | 0.5405 | 0.541 | 0.000 | (0;000) | ✗ | 30/01/17 |
K2AsAuS4 | ICSD | 85681 | P2_1/m (11) | ✔ | 16 | 116 | 3 | 0.8772 | 0.877 | 0.000 | (0;000) | ✗ | 30/01/17 |
Rb2TaAgS4 | ICSD | 84295 | Fddd (70) | ✔ | 16 | 132 | 1 | 2.5821 | 2.591 | 0.000 | (0;000) | ✗ | 30/01/17 |
Hg2ClO | COD | 2310659 | C2/c (15) | ✔ | 16 | 148 | 3 | 1.3653 | 1.404 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlHCO2 | ICSD | 110364 | Pnna (52) | ✔ | 20 | 120 | 1 | 3.0824 | 3.082 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaZrCuS3 | ICSD | 73887 | Cmcm (63) | ✔ | 12 | 84 | 2 | 0.5112 | 0.542 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ga3Ru | ICSD | 412078 | P4_2/mnm (136) | ✔ | 16 | 220 | 3 | 0.3066 | 0.673 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaPS3 | ICSD | 405192 | P2_1/c (14) | ✔ | 20 | 132 | 1 | 3.1376 | 3.138 | 0.000 | (0;000) | ✗ | 02/02/17 |