▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Na2BeB2O5 | COD | 2214424 | C2/c (15) | ✔ | 20 | 116 | 1 | 4.9414 | 4.981 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd2B2O5 | COD | 2202291 | P-1 (2) | ✔ | 18 | 120 | 3 | 2.687 | 2.709 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd(GaSe2)2 | ICSD | 619892 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.6831 | 1.683 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd(GaSe2)2 | ICSD | 619895 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.4918 | 1.492 | 0.000 | (0;000) | ✗ | 06/10/16 |
Y(CoB)4 | ICSD | 613410 | P4_2/nmc (137) | ✔ | 18 | 182 | 3 | 0.0 | 0.000 | 0.885 | (0;000) | ✗ | 05/01/17 |
Cd(GaSe2)2 | ICSD | 619900 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.5523 | 1.552 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfB4Ir3 | COD | 2105436 | P6_3/m (176) | ✔ | 16 | 150 | 3 | 0.0 | 0.000 | 0.587 | (0;000) | ✗ | 05/01/17 |
Cd(GaSe2)2 | ICSD | 93761 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.3533 | 1.353 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZrB4Ir3 | ICSD | 614583 | P6_3/m (176) | ✔ | 16 | 134 | 3 | 0.0 | 0.000 | 0.667 | (0;000) | ✗ | 05/01/17 |
Sc2GaB2Rh5 | ICSD | 51438 | P4/mbm (127) | ✔ | 20 | 252 | 3 | 0.0 | 0.001 | 0.399 | (0;000) | ✗ | 02/02/17 |
MgB4 | COD | 1511477 | Pnma (62) | ✔ | 20 | 88 | 3 | 0.2631 | 0.700 | 0.000 | (0;000) | ✗ | 05/01/17 |
Mg2GeB2Rh5 | ICSD | 51432 | P4/mbm (127) | ✔ | 20 | 230 | 3 | 0.0 | 0.000 | 0.993 | (0;000) | ✗ | 02/02/17 |
Cd(GaTe2)2 | ICSD | 25646 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.959 | 0.959 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd(GaTe2)2 | ICSD | 656264 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.9368 | 0.937 | 0.000 | (0;000) | ✗ | 06/10/16 |
MnB4 | ICSD | 425100 | P2_1/c (14) | ✔ | 10 | 54 | 3 | 0.0 | 0.000 | 0.914 | (0;000) | ✗ | 05/01/17 |
Cd(GaTe2)2 | ICSD | 659216 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.9348 | 0.935 | 0.000 | (0;000) | ✗ | 06/10/16 |
B4Mo | ICSD | 182095 | P6_3/mmc (194) | ✔ | 20 | 104 | 3 | 0.0 | 0.002 | 0.542 | (0;000) | ✗ | 05/01/17 |
Mg2VB2Ir5 | ICSD | 614538 | P4/mbm (127) | ✔ | 20 | 248 | 3 | 0.0 | 0.011 | 0.610 | (0;000) | ✗ | 02/02/17 |
B4Rh5 | COD | 1511510 | P6_3/mmc (194) | ✔ | 18 | 194 | 3 | 0.0 | 0.000 | 0.866 | (0;000) | ✗ | 05/01/17 |
Cd(InSe2)2 | ICSD | 151954 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.8879 | 0.888 | 0.000 | (0;000) | ✗ | 06/10/16 |
SiB4 | ICSD | 615435 | R-3m (166) | ✔ | 15 | 48 | 3 | 0.6561 | 1.387 | 0.000 | (0;000) | ✗ | 05/01/17 |
V2B2Ir | ICSD | 601555 | Pnnm (58) | ✔ | 20 | 196 | 3 | 0.0 | 0.005 | 0.489 | (0;000) | ✗ | 02/02/17 |
Li2B2S5 | COD | 1510745 | Cmcm (63) | ✔ | 18 | 84 | 1 | 2.4066 | 2.475 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li2B2Se5 | COD | 1510746 | C2/c (15) | ✔ | 18 | 84 | 3 | 1.7208 | 1.912 | 0.000 | (0;000) | ✗ | 02/02/17 |
B2Mo2Os | ICSD | 614829 | Pnnm (58) | ✔ | 20 | 200 | 3 | 0.0 | 0.014 | 0.834 | (0;000) | ✗ | 02/02/17 |
B2Mo2Ru | ICSD | 601573 | Pnnm (58) | ✔ | 20 | 200 | 3 | 0.0 | 0.017 | 0.783 | (0;000) | ✗ | 02/02/17 |
Nb2B2Os | ICSD | 425655 | P4/mnc (128) | ✔ | 20 | 192 | 3 | 0.0 | 0.005 | 0.534 | (0;000) | ✗ | 02/02/17 |
NO2 | ICSD | 28331 | P2_1/c (14) | ✔ | 12 | 68 | 1 | 2.5717 | 2.624 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr(NiB)2 | ICSD | 615019 | Pnnm (58) | ✔ | 20 | 144 | 3 | 0.0 | 0.016 | 0.540 | (0;000) | ✗ | 02/02/17 |
RbI | ICSD | 61523 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 3.0742 | 3.078 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ta2B2Os | ICSD | 429117 | P4/mnc (128) | ✔ | 20 | 192 | 3 | 0.0 | 0.006 | 0.527 | (0;000) | ✗ | 02/02/17 |
Ga2Os | ICSD | 103785 | Fddd (70) | ✔ | 6 | 84 | 3 | 0.5627 | 0.794 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ba4Na(BN2)3 | ICSD | 401210 | Im-3m (229) | ✔ | 14 | 88 | 1 | 2.0643 | 2.504 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs(BH)3 | ICSD | 65508 | Fm-3m (225) | ✔ | 14 | 42 | 2 | 4.0127 | 4.210 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr4Li(BN2)3 | ICSD | 402173 | Im-3m (229) | ✔ | 14 | 82 | 1 | 2.0978 | 2.998 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaSr4(BN2)3 | ICSD | 92577 | Im-3m (229) | ✔ | 14 | 88 | 1 | 2.009 | 2.830 | 0.000 | (0;000) | ✗ | 02/02/17 |
SiH | ICSD | 41478 | P-3m1 (164) | ✔ | 4 | 10 | 2 | 2.0532 | 2.092 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2Sc2B4O11 | ICSD | 86435 | P-1 (2) | ✔ | 19 | 120 | 3 | 4.5568 | 4.606 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdAs | ICSD | 432 | Pbca (61) | ✔ | 16 | 136 | 3 | 0.1609 | 0.448 | 0.000 | (0;000) | ✗ | 30/01/17 |
Y(ReB)4 | ICSD | 615286 | P4_2/nmc (137) | ✔ | 18 | 166 | 3 | 0.0 | 0.000 | 0.907 | (0;000) | ✗ | 02/02/17 |
Y(BRh)4 | COD | 1511508 | P4_2/nmc (137) | ✔ | 18 | 182 | 3 | 0.0 | 0.000 | 0.889 | (0;000) | ✗ | 02/02/17 |
CaB6 | COD | 1011310 | Pm-3m (221) | ✔ | 7 | 28 | 3 | 0.1914 | 0.191 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cd(InTe2)2 | ICSD | 25651 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.8133 | 0.813 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr(Ni2B)6 | COD | 8103490 | R-3m (166) | ✔ | 19 | 148 | 3 | 0.0 | 0.001 | 0.724 | (0;000) | ✗ | 05/01/17 |
Cd(InTe2)2 | ICSD | 620058 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.8795 | 0.880 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr3(B3Rh4)2 | COD | 1511642 | Fmmm (69) | ✔ | 17 | 184 | 3 | 0.0 | 0.006 | 0.684 | (0;000) | ✗ | 02/02/17 |
B6O | COD | 1511635 | R-3m (166) | ✔ | 14 | 48 | 3 | 1.679 | 1.679 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2Bi2O5 | ICSD | 69864 | P2_1/c (14) | ✔ | 18 | 160 | 2 | 1.8699 | 2.004 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba2ZnBi2 | COD | 4315627 | Ibam (72) | ✔ | 10 | 124 | 1 | 0.0 | 0.008 | 0.301 | (0;000) | ✗ | 02/02/17 |
Ba2Br2O | ICSD | 423479 | Ibam (72) | ✔ | 10 | 80 | 1 | 3.1921 | 3.288 | 0.000 | (0;000) | ✗ | 02/02/17 |