▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▴ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BaN2 | ICSD | 280681 | C2/c (15) | ✔ | 6 | 40 | 1 | 0.0 | 0.007 | 0.652 | (0;000) | ✔ | 06/10/16 |
BaS2 | ICSD | 2004 | C2/c (15) | ✔ | 6 | 44 | 1 | 1.5522 | 1.591 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaS3 | ICSD | 23637 | P-42_1m (113) | ✗ | 8 | 56 | 1 | 1.3893 | 1.418 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaSe2 | ICSD | 16358 | C2/c (15) | ✔ | 6 | 44 | 1 | 1.009 | 1.076 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaSe3 | ICSD | 16359 | P-42_1m (113) | ✗ | 8 | 56 | 1 | 0.9646 | 1.065 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTe3 | ICSD | 36366 | P-42_1m (113) | ✗ | 8 | 56 | 1 | 0.719 | 0.730 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeF2 | ICSD | 261194 | P3_121 (152) | ✗ | 9 | 54 | 3 | 8.5108 | 8.658 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeF2 | ICSD | 9481 | P6_222 (180) | ✗ | 9 | 54 | 1 | 8.125 | 8.200 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeO | ICSD | 163467 | F-43m (216) | ✗ | 2 | 10 | 1 | 6.9092 | 7.605 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeO | ICSD | 601160 | P6_3mc (186) | ✗ | 4 | 20 | 1 | 7.4832 | 7.483 | 0.000 | (0;000) | ✗ | 06/10/16 |
BePo | ICSD | 58730 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.8057 | 1.059 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeS | ICSD | 183373 | F-43m (216) | ✗ | 2 | 10 | 1 | 3.0264 | 5.598 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeSe | ICSD | 183374 | F-43m (216) | ✗ | 2 | 10 | 1 | 2.4499 | 4.314 | 0.000 | (0;000) | ✗ | 06/10/16 |
BeTe | ICSD | 183375 | F-43m (216) | ✗ | 2 | 10 | 1 | 1.572 | 3.253 | 0.000 | (0;000) | ✗ | 06/10/16 |
Be3N2 | ICSD | 185490 | R3m (160) | ✗ | 5 | 22 | 1 | 2.7756 | 3.816 | 0.000 | (0;000) | ✗ | 06/10/16 |
Be5Pt | ICSD | 616395 | F-43m (216) | ✗ | 6 | 30 | 1 | 0.0 | 0.584 | 0.071 | (0;000) | ✔ | 06/10/16 |
BiBr3 | ICSD | 100294 | C2/m (12) | ✔ | 8 | 72 | 2 | 2.0254 | 2.057 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiF3 | ICSD | 25567 | P-43m (215) | ✗ | 16 | 104 | 3 | 2.8752 | 2.876 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaBi | ICSD | 167768 | F-43m (216) | ✗ | 2 | 28 | 3 | 0.0 | 0.000 | 0.253 | (1;000) | ✔ | 06/10/16 |
BiI3 | ICSD | 187608 | P2_1 (4) | ✗ | 8 | 52 | 3 | 0.0 | 0.431 | 0.407 | (0;000) | ✔ | 06/10/16 |
InBi | ICSD | 184573 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.245 | (1;000) | ✔ | 06/10/16 |
BiSe | ICSD | 72197 | F2mm (42) | ✗ | 4 | 42 | 2 | 0.0 | 0.033 | 0.537 | (1;110) | ✔ | 06/10/16 |
Bi2O3 | ICSD | 168808 | P-4m2 (115) | ✗ | 5 | 28 | 3 | 0.0567 | 0.494 | 0.000 | (0;000) | ✔ | 06/10/16 |
Bi2O3 | ICSD | 168810 | R3m (160) | ✗ | 10 | 56 | 2 | 2.2643 | 2.309 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2O3 | ICSD | 168812 | P-42_1c (114) | ✗ | 20 | 112 | 3 | 1.4533 | 1.453 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2O3 | ICSD | 169685 | P31c (159) | ✗ | 20 | 112 | 3 | 1.2724 | 1.273 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2O3 | ICSD | 422451 | P6_3mc (186) | ✗ | 20 | 112 | 3 | 1.424 | 1.583 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2Pd | ICSD | 42565 | C2/m (12) | ✔ | 6 | 80 | 3 | 0.0 | 0.126 | 0.692 | (1;000) | ✔ | 06/10/16 |
Bi2Pt | ICSD | 428088 | P31m (157) | ✗ | 9 | 60 | 3 | 0.0 | 0.005 | 0.393 | (0;000) | ✔ | 06/10/16 |
Bi2Te3 | ICSD | 20289 | R3m (160) | ✗ | 5 | 28 | 3 | 0.0 | 0.026 | 0.183 | (1;111) | ✔ | 06/10/16 |
BrCl | ICSD | 424850 | Cmc2_1 (36) | ✗ | 4 | 28 | 1 | 1.895 | 1.911 | 0.000 | (0;000) | ✗ | 06/10/16 |
CuBr | ICSD | 23989 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3072 | 0.310 | 0.000 | (0;000) | ✔ | 06/10/16 |
BrF3 | ICSD | 31689 | Ccm2_1 (36) | ✗ | 8 | 56 | 1 | 2.3987 | 2.540 | 0.000 | (0;000) | ✗ | 06/10/16 |
BrF5 | ICSD | 31690 | Ccm2_1 (36) | ✗ | 12 | 84 | 1 | 4.0507 | 4.134 | 0.000 | (0;000) | ✗ | 06/10/16 |
IBr | ICSD | 22120 | Cmc2_1 (36) | ✗ | 4 | 28 | 1 | 1.2772 | 1.287 | 0.000 | (0;000) | ✗ | 06/10/16 |
CdBr2 | ICSD | 25782 | P6_3mc (186) | ✗ | 6 | 52 | 2 | 2.6943 | 2.694 | 0.000 | (0;000) | ✗ | 06/10/16 |
HgBr2 | ICSD | 151889 | P3 (143) | ✗ | 9 | 78 | 2 | 1.0032 | 1.272 | 0.000 | (0;000) | ✗ | 06/10/16 |
HgBr2 | ICSD | 36158 | Ccm2_1 (36) | ✗ | 6 | 52 | 2 | 2.1612 | 2.218 | 0.000 | (0;000) | ✗ | 06/10/16 |
SBr | ICSD | 37020 | Cc2e (41) | ✗ | 8 | 52 | 1 | 2.0962 | 2.254 | 0.000 | (0;000) | ✗ | 06/10/16 |
SeBr | ICSD | 37019 | Cc2e (41) | ✗ | 8 | 52 | 1 | 1.6226 | 1.760 | 0.000 | (0;000) | ✗ | 06/10/16 |
IrBr3 | ICSD | 14212 | C2/m (12) | ✔ | 8 | 60 | 2 | 1.4173 | 1.460 | 0.000 | (0;000) | ✗ | 06/10/16 |
RuBr3 | ICSD | 28119 | Cm2m (38) | ✗ | 8 | 74 | 1 | 0.0 | 0.064 | 0.330 | (0;000) | ✔ | 06/10/16 |
CdC | ICSD | 183178 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.000 | 0.842 | (0;000) | ✔ | 06/10/16 |
CrC | ICSD | 181709 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.443 | (0;100) | ✔ | 06/10/16 |
CF4 | ICSD | 2848 | C2/c (15) | ✔ | 10 | 64 | 1 | 9.4116 | 9.472 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeC | ICSD | 182363 | F-43m (216) | ✗ | 2 | 8 | 3 | 1.5913 | 3.553 | 0.000 | (0;000) | ✗ | 06/10/16 |
HC | ICSD | 187642 | I2_13 (199) | ✗ | 8 | 20 | 3 | 4.8022 | 6.465 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfC | ICSD | 185992 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.2904 | 0.290 | 0.000 | (0;000) | ✔ | 06/10/16 |
CI4 | ICSD | 30789 | I-42m (121) | ✗ | 5 | 32 | 1 | 0.9413 | 0.943 | 0.000 | (0;000) | ✗ | 06/10/16 |
MoC | ICSD | 183166 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.417 | (0;000) | ✔ | 06/10/16 |