▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▴ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BMo2 | COD | 1511240 | I4/mcm (140) | ✔ | 6 | 62 | 3 | 0.0 | 0.000 | 0.653 | (1;000) | ✗ | 27/01/17 |
BMo | ICSD | 614812 | Cmcm (63) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.780 | (0;000) | ✗ | 27/01/17 |
BMo | COD | 9008953 | I4_1/amd (141) | ✔ | 8 | 68 | 3 | 0.0 | 0.032 | 0.690 | (1;111) | ✗ | 27/01/17 |
RbNa2BO3 | ICSD | 67525 | Pmmn (59) | ✔ | 14 | 96 | 1 | 3.0903 | 3.330 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaBPt3 | COD | 1511249 | P6/mmm (191) | ✔ | 10 | 84 | 3 | 0.0 | 0.039 | 0.685 | (1;000) | ✗ | 27/01/17 |
NbNiB | COD | 1511255 | Cmcm (63) | ✔ | 6 | 52 | 3 | 0.0 | 0.011 | 0.215 | (1;110) | ✗ | 27/01/17 |
NbBO4 | COD | 9012847 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 2.8207 | 2.846 | 0.000 | (0;000) | ✗ | 27/01/17 |
NbB | COD | 1511254 | Cmcm (63) | ✔ | 4 | 32 | 3 | 0.0 | 0.024 | 0.365 | (1;000) | ✗ | 27/01/17 |
Ni2B | COD | 1511265 | I4/mcm (140) | ✔ | 6 | 46 | 3 | 0.0 | 0.001 | 0.828 | (0;111) | ✗ | 27/01/17 |
Ni3B | ICSD | 614985 | Pnma (62) | ✔ | 16 | 132 | 3 | 0.0 | 0.000 | 0.646 | (0;110) | ✗ | 27/01/17 |
YNi4B | COD | 8000084 | P6/mmm (191) | ✔ | 12 | 108 | 3 | 0.0 | 0.007 | 0.649 | (0;000) | ✗ | 27/01/17 |
BN | ICSD | 186248 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 3.5701 | 3.601 | 0.000 | (0;000) | ✗ | 27/01/17 |
BN | ICSD | 236992 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 4.2811 | 4.562 | 0.000 | (0;000) | ✗ | 27/01/17 |
NiB | COD | 9008947 | Cmcm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.399 | (0;110) | ✗ | 27/01/17 |
TaNiB | ICSD | 615023 | Cmcm (63) | ✔ | 6 | 52 | 3 | 0.0 | 0.029 | 0.198 | (1;110) | ✗ | 27/01/17 |
BN | COD | 1010331 | P6/mmm (191) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.351 | (0;000) | ✗ | 27/01/17 |
BN | COD | 2016173 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 4.1848 | 4.579 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScBO3 | COD | 2018876 | R-3c (167) | ✔ | 10 | 64 | 3 | 4.2967 | 4.297 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiBO3 | COD | 8103469 | R-3c (167) | ✔ | 10 | 66 | 3 | 0.0 | 0.000 | 0.815 | (0;000) | ✗ | 27/01/17 |
VBO3 | COD | 7209472 | R-3c (167) | ✔ | 10 | 68 | 3 | 0.0 | 0.007 | 0.763 | (0;000) | ✗ | 27/01/17 |
TaBO4 | COD | 1511288 | I4_1/amd (141) | ✔ | 12 | 80 | 3 | 3.5135 | 3.581 | 0.000 | (0;000) | ✗ | 27/01/17 |
B | COD | 1512492 | R-3m (166) | ✔ | 12 | 36 | 3 | 1.4362 | 1.829 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sc3BPb | COD | 1511293 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.106 | (1;000) | ✗ | 27/01/17 |
BPd2 | COD | 1511294 | Pnnm (58) | ✔ | 6 | 78 | 3 | 0.0 | 0.000 | 0.880 | (1;010) | ✗ | 27/01/17 |
BPd3 | COD | 1511295 | Pnma (62) | ✔ | 16 | 228 | 3 | 0.0 | 0.000 | 0.634 | (1;110) | ✗ | 27/01/17 |
BPt2 | ICSD | 615207 | P6_3/mmc (194) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.880 | (0;001) | ✗ | 27/01/17 |
BPt | COD | 1511304 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.556 | (1;000) | ✗ | 27/01/17 |
BPt | COD | 9008910 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.822 | (0;000) | ✗ | 27/01/17 |
Ca3SiBr2 | COD | 1521781 | I4/mmm (139) | ✔ | 6 | 48 | 1 | 0.0 | 0.005 | 0.315 | (0;111) | ✗ | 27/01/17 |
Ca3SiBr2 | COD | 1521782 | Immm (71) | ✔ | 6 | 48 | 1 | 0.0 | 0.012 | 0.022 | (1;000) | ✗ | 27/01/17 |
Ca3SiBr2 | COD | 1521783 | P-3m1 (164) | ✔ | 6 | 48 | 1 | 0.0 | 0.005 | 0.399 | (0;000) | ✗ | 27/01/17 |
Ca3SiBr2 | COD | 1521784 | R-3m (166) | ✔ | 6 | 48 | 1 | 0.0 | 0.001 | 0.479 | (0;000) | ✗ | 27/01/17 |
CaBr2 | COD | 4031227 | Pnnm (58) | ✔ | 6 | 48 | 1 | 4.4868 | 4.487 | 0.000 | (0;000) | ✗ | 27/01/17 |
CdBr2 | COD | 9009124 | R-3m (166) | ✔ | 3 | 26 | 2 | 2.7703 | 2.910 | 0.000 | (0;000) | ✗ | 27/01/17 |
CrBr2 | ICSD | 23903 | C2/m (12) | ✔ | 3 | 28 | 2 | 0.0 | 0.045 | 0.565 | (0;000) | ✔ | 27/01/17 |
CsBr2F | ICSD | 84019 | P4/mmm (123) | ✔ | 4 | 30 | 1 | 1.4039 | 1.404 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeBr2 | COD | 9009102 | P-3m1 (164) | ✔ | 3 | 22 | 2 | 0.3824 | 0.406 | 0.000 | (0;000) | ✗ | 27/01/17 |
HgBr2 | COD | 9009213 | Cmcm (63) | ✔ | 12 | 104 | 3 | 0.0 | 0.025 | 0.460 | (0;110) | ✗ | 27/01/17 |
K4Br2O | COD | 9007797 | Fmmm (69) | ✔ | 7 | 56 | 1 | 0.7286 | 0.729 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li5Br2N | ICSD | 78836 | Immm (71) | ✔ | 8 | 34 | 1 | 2.2057 | 2.383 | 0.000 | (0;000) | ✗ | 27/01/17 |
MgBr2 | COD | 9009107 | P-3m1 (164) | ✔ | 3 | 24 | 2 | 4.1115 | 4.112 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na4Br2O | ICSD | 67283 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 2.068 | 2.068 | 0.000 | (0;000) | ✗ | 27/01/17 |
NiBr2 | COD | 9008013 | R-3m (166) | ✔ | 3 | 24 | 2 | 0.0 | 0.031 | 0.538 | (0;000) | ✗ | 27/01/17 |
PdBr2 | ICSD | 27443 | C2/c (15) | ✔ | 6 | 64 | 1 | 0.509 | 0.945 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiBr2 | ICSD | 26078 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 0.0 | 0.005 | 0.539 | (0;000) | ✗ | 27/01/17 |
ZnBr2 | COD | 9011540 | R-3m (166) | ✔ | 3 | 26 | 2 | 2.4418 | 2.445 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsCaBr3 | ICSD | 77242 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 4.484 | 4.646 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsCdBr3 | COD | 1010122 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.8231 | 1.294 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsGeBr3 | ICSD | 80320 | Pm-3m (221) | ✔ | 5 | 34 | 3 | 0.0 | 0.090 | 0.026 | (1;111) | ✗ | 27/01/17 |
CsHgBr3 | COD | 1010118 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.000 | 0.157 | (1;000) | ✗ | 27/01/17 |