▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
H3C2O | COD | 2005623 | Fdd2 (43) | ✗ | 24 | 68 | 2 | 4.9086 | 5.077 | 0.000 | (0;000) | ✗ | 04/08/17 |
CoB4O7 | ICSD | 420402 | Cmcm (63) | ✔ | 24 | 142 | 3 | 0.0 | 0.000 | 0.488 | (0;110) | ✗ | 04/08/17 |
CaB4O7 | COD | 7209486 | Pmn2_1 (31) | ✗ | 24 | 128 | 3 | 6.4573 | 6.760 | 0.000 | (0;000) | ✗ | 04/08/17 |
YB4Mo | COD | 1511488 | Pbam (55) | ✔ | 24 | 148 | 3 | 0.0 | 0.113 | 0.250 | (0;000) | ✗ | 04/08/17 |
ScFeB4 | ICSD | 614180 | Pbam (55) | ✔ | 24 | 124 | 3 | 0.0 | 0.003 | 0.524 | (0;000) | ✗ | 04/08/17 |
FeB4O7 | ICSD | 420401 | Cmcm (63) | ✔ | 24 | 124 | 3 | 0.0 | 0.001 | 0.095 | (1;110) | ✗ | 04/08/17 |
CuB4O7 | ICSD | 391408 | Cmcm (63) | ✔ | 24 | 130 | 3 | 0.0 | 0.000 | 0.905 | (0;110) | ✗ | 04/08/17 |
MnB4O7 | ICSD | 391409 | Cmcm (63) | ✔ | 24 | 138 | 3 | 0.0 | 0.000 | 0.469 | (0;000) | ✗ | 04/08/17 |
HgB4O7 | COD | 7209503 | Pmn2_1 (31) | ✗ | 24 | 132 | 3 | 2.0827 | 2.216 | 0.000 | (0;000) | ✗ | 04/08/17 |
SnB4O7 | COD | 4001283 | Pmn2_1 (31) | ✗ | 24 | 136 | 3 | 3.5975 | 4.248 | 0.000 | (0;000) | ✗ | 04/08/17 |
YVB4 | ICSD | 615679 | Pbam (55) | ✔ | 24 | 144 | 3 | 0.0 | 0.010 | 0.208 | (1;000) | ✗ | 04/08/17 |
BaBeF4 | COD | 5910312 | Pnma (62) | ✔ | 24 | 168 | 1 | 7.8184 | 7.862 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba2CdSe3 | ICSD | 66653 | Pnma (62) | ✔ | 24 | 200 | 1 | 1.6033 | 1.603 | 0.000 | (0;000) | ✗ | 04/08/17 |
YNiB4 | ICSD | 615085 | I4/mmm (139) | ✔ | 24 | 132 | 3 | 0.0 | 0.001 | 0.623 | (0;111) | ✗ | 04/08/17 |
B4PbO7 | ICSD | 185673 | Pmn2_1 (31) | ✗ | 24 | 136 | 3 | 3.7884 | 4.333 | 0.000 | (0;000) | ✗ | 04/08/17 |
YB4Ru | ICSD | 615400 | Pbam (55) | ✔ | 24 | 156 | 3 | 0.0 | 0.005 | 0.421 | (0;000) | ✗ | 04/08/17 |
ZnB4O7 | COD | 1511503 | Cmcm (63) | ✔ | 24 | 132 | 3 | 5.6691 | 5.869 | 0.000 | (0;000) | ✗ | 04/08/17 |
SrB4O7 | COD | 1511501 | Pmn2_1 (31) | ✗ | 24 | 128 | 3 | 4.9996 | 5.180 | 0.000 | (0;000) | ✗ | 04/08/17 |
YB4Rh | ICSD | 419358 | Pbam (55) | ✔ | 24 | 160 | 3 | 0.0 | 0.021 | 0.343 | (1;000) | ✗ | 04/08/17 |
YReB4 | ICSD | 615278 | Pbam (55) | ✔ | 24 | 152 | 3 | 0.0 | 0.009 | 0.494 | (0;100) | ✗ | 04/08/17 |
YB4Os | ICSD | 615147 | Pbam (55) | ✔ | 24 | 156 | 3 | 0.0 | 0.006 | 0.393 | (0;000) | ✗ | 04/08/17 |
Ba2CdS3 | ICSD | 66654 | Pnma (62) | ✔ | 24 | 200 | 1 | 2.223 | 2.223 | 0.000 | (0;000) | ✗ | 04/08/17 |
Te2Br | COD | 1527657 | Pnma (62) | ✔ | 24 | 152 | 1 | 0.0 | 0.462 | 0.060 | (0;000) | ✗ | 04/08/17 |
Hg2P3Br | ICSD | 74770 | Pbcn (60) | ✔ | 24 | 184 | 3 | 0.9959 | 1.171 | 0.000 | (0;000) | ✗ | 04/08/17 |
RbBS2 | COD | 1510950 | R-3c (167) | ✔ | 24 | 144 | 1 | 2.7693 | 2.769 | 0.000 | (0;000) | ✗ | 04/08/17 |
AgC2N3 | COD | 9007855 | Pnma (62) | ✔ | 24 | 136 | 3 | 3.3948 | 3.569 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba2FeS3 | ICSD | 615850 | Pnma (62) | ✔ | 24 | 184 | 1 | 0.0 | 0.004 | 0.943 | (1;000) | ✗ | 04/08/17 |
Ba2MnSe3 | ICSD | 26230 | Pnma (62) | ✔ | 24 | 212 | 1 | 0.0 | 0.000 | 0.902 | (0;101) | ✗ | 04/08/17 |
Ba2CoS3 | ICSD | 160295 | Pnma (62) | ✔ | 24 | 220 | 1 | 0.0 | 0.001 | 0.963 | (0;011) | ✗ | 04/08/17 |
Ba2CdTe3 | COD | 2236699 | Pnma (62) | ✔ | 24 | 200 | 1 | 1.2195 | 1.220 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba2FeSe3 | ICSD | 615861 | Pnma (62) | ✔ | 24 | 184 | 1 | 0.0 | 0.003 | 0.935 | (1;000) | ✗ | 04/08/17 |
Ba2MnS3 | ICSD | 603195 | Pnma (62) | ✔ | 24 | 212 | 1 | 0.0 | 0.000 | 0.930 | (1;011) | ✗ | 04/08/17 |
Ba2MnO3 | COD | 2002251 | Cc (9) | ✗ | 24 | 212 | 3 | 0.0 | 0.000 | 0.113 | ? | ✗ | 04/08/17 |
Ba2HgS3 | ICSD | 32647 | Pnma (62) | ✔ | 24 | 200 | 1 | 1.4448 | 1.445 | 0.000 | (0;000) | ✗ | 04/08/17 |
GaBr2 | ICSD | 62665 | Pnna (52) | ✔ | 24 | 216 | 1 | 2.928 | 3.007 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsGaBr4 | ICSD | 4037 | Pnma (62) | ✔ | 24 | 200 | 1 | 3.931 | 3.931 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba2NbN3 | ICSD | 74906 | C2/c (15) | ✔ | 24 | 192 | 1 | 1.9768 | 1.997 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba6Ga5N | ICSD | 77731 | R-3c (167) | ✔ | 24 | 260 | 1 | 0.0 | 0.003 | 0.093 | (1;000) | ✗ | 04/08/17 |
Ba2MnTe3 | COD | 7221357 | Pnma (62) | ✔ | 24 | 212 | 1 | 0.0 | 0.001 | 0.869 | (1;011) | ✗ | 04/08/17 |
Ba2P3Pd | ICSD | 75019 | P2_1/c (14) | ✔ | 24 | 212 | 1 | 0.0 | 0.016 | 0.369 | (1;000) | ✗ | 04/08/17 |
Ba2TaN3 | ICSD | 74503 | C2/c (15) | ✔ | 24 | 192 | 1 | 2.0204 | 2.027 | 0.000 | (0;000) | ✗ | 04/08/17 |
InGaBr4 | ICSD | 69652 | P2/c (13) | ✔ | 24 | 216 | 2 | 3.0369 | 3.128 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba2ZnO3 | COD | 2002534 | C2/c (15) | ✔ | 24 | 200 | 2 | 2.883 | 2.885 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba2VN3 | ICSD | 80177 | Cmce (64) | ✔ | 24 | 192 | 2 | 0.8948 | 0.895 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba2ZnS3 | COD | 4327809 | Pnma (62) | ✔ | 24 | 200 | 1 | 2.0228 | 2.023 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba5Ta4O15 | COD | 2310386 | P-3m1 (164) | ✔ | 24 | 192 | 1 | 0.8298 | 0.831 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba3Zr2S7 | ICSD | 69854 | Cccm (66) | ✔ | 24 | 160 | 2 | 0.1761 | 0.176 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba3Sb2O | COD | 2011977 | Pbam (55) | ✔ | 24 | 184 | 1 | 0.3331 | 0.455 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba5Ta4O15 | COD | 2106435 | P-3m1 (164) | ✔ | 24 | 192 | 1 | 0.3425 | 0.343 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba5Nb4O15 | ICSD | 95192 | P-3m1 (164) | ✔ | 24 | 192 | 1 | 2.8172 | 2.827 | 0.000 | (0;000) | ✗ | 04/08/17 |