▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▴ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BaCrF6 | COD | 1525278 | R-3m (166) | ✔ | 8 | 66 | 1 | 0.0 | 0.000 | 0.174 | (0;000) | ✗ | 05/01/17 |
BaCrS2 | COD | 4321901 | Pmmn (59) | ✔ | 8 | 72 | 2 | 0.0 | 0.013 | 0.275 | (0;000) | ✗ | 05/01/17 |
Ba(CuO)2 | COD | 2002215 | I4_1/amd (141) | ✔ | 10 | 88 | 3 | 1.3364 | 1.336 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba(CuS)2 | ICSD | 615832 | I4/mmm (139) | ✔ | 5 | 44 | 2 | 0.5441 | 0.544 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba(CuSe)2 | COD | 1521196 | I4/mmm (139) | ✔ | 5 | 44 | 2 | 0.3094 | 0.309 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaCuSeF | ICSD | 75585 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 1.4025 | 1.403 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaCuSF | ICSD | 183712 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 1.6889 | 1.689 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaCuTeF | ICSD | 245624 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.8274 | 0.827 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaCuP | ICSD | 52684 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.0 | 0.374 | 0.167 | (0;000) | ✗ | 05/01/17 |
BaCuSb | ICSD | 57020 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.123 | 0.162 | (0;000) | ✗ | 05/01/17 |
BaF2 | ICSD | 41650 | Pnma (62) | ✔ | 12 | 96 | 1 | 7.3138 | 7.314 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaF2 | ICSD | 41651 | P6_3/mmc (194) | ✔ | 6 | 48 | 2 | 5.7976 | 6.002 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaF2 | COD | 9009004 | Fm-3m (225) | ✔ | 3 | 24 | 1 | 6.7708 | 6.829 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaLiF3 | ICSD | 45310 | Pm-3m (221) | ✔ | 5 | 34 | 1 | 6.6401 | 6.640 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaGeF6 | COD | 1010206 | R-3m (166) | ✔ | 8 | 56 | 1 | 6.4215 | 6.422 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaNiF6 | ICSD | 35396 | R-3m (166) | ✔ | 8 | 62 | 1 | 1.4123 | 1.426 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaPbF6 | ICSD | 25521 | R-3m (166) | ✔ | 8 | 66 | 1 | 3.4266 | 3.427 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaSiF6 | COD | 1530106 | R-3m (166) | ✔ | 8 | 56 | 1 | 7.8259 | 7.826 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaSnF6 | ICSD | 33788 | R-3 (148) | ✔ | 8 | 66 | 1 | 5.7036 | 5.704 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaTiF6 | ICSD | 33789 | R-3m (166) | ✔ | 8 | 64 | 1 | 4.8484 | 4.971 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaFe2(PO4)2 | ICSD | 237763 | P-1 (2) | ✔ | 13 | 84 | 2 | 0.0 | 0.011 | 0.134 | (0;001) | ✗ | 05/01/17 |
BaFe2(PO4)2 | ICSD | 424895 | R-3 (148) | ✔ | 13 | 84 | 2 | 0.1447 | 0.225 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba(FeP)2 | COD | 7221161 | I4/mmm (139) | ✔ | 5 | 36 | 2 | 0.0 | 0.005 | 0.524 | (1;111) | ✗ | 05/01/17 |
Ba(FeS2)2 | ICSD | 23081 | I4/m (87) | ✔ | 7 | 50 | 1 | 0.0 | 0.002 | 0.245 | (0;111) | ✗ | 05/01/17 |
BaFeO3 | ICSD | 262131 | Pm-3m (221) | ✔ | 5 | 36 | 3 | 0.0 | 0.000 | 0.821 | (1;000) | ✗ | 05/01/17 |
BaMnPF | COD | 7203816 | P4/nmm (129) | ✔ | 8 | 74 | 1 | 0.0 | 0.000 | 0.850 | (0;001) | ✗ | 05/01/17 |
BaMnSbF | ICSD | 248366 | P4/nmm (129) | ✔ | 8 | 74 | 1 | 0.0 | 0.000 | 0.872 | (0;000) | ✗ | 05/01/17 |
BaZnPF | COD | 7203812 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.416 | 0.416 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaZnSbF | COD | 7203813 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.0 | 0.028 | 0.046 | (0;000) | ✗ | 05/01/17 |
BaGa2 | ICSD | 58649 | P6/mmm (191) | ✔ | 3 | 36 | 2 | 0.0 | 0.013 | 0.482 | (1;000) | ✗ | 05/01/17 |
BaGa4 | ICSD | 615865 | I4/mmm (139) | ✔ | 5 | 62 | 3 | 0.0 | 0.016 | 0.239 | (1;000) | ✗ | 05/01/17 |
BaLi2(MgGe)2 | COD | 8101153 | R-3m (166) | ✔ | 7 | 44 | 1 | 0.0 | 0.117 | 0.220 | (0;000) | ✗ | 05/01/17 |
Ba(MgGe)2 | ICSD | 25312 | I4/mmm (139) | ✔ | 5 | 38 | 3 | 0.0 | 0.014 | 0.260 | (1;111) | ✗ | 05/01/17 |
Ba(MnGe)2 | ICSD | 404 | I4/mmm (139) | ✔ | 5 | 48 | 3 | 0.0 | 0.001 | 0.733 | (0;000) | ✗ | 05/01/17 |
BaGe2 | COD | 7221343 | I4_1/amd (141) | ✔ | 6 | 36 | 3 | 0.0 | 0.005 | 0.182 | (1;111) | ✗ | 05/01/17 |
Ba(GeRh)2 | ICSD | 77146 | I4/mmm (139) | ✔ | 5 | 52 | 2 | 0.0 | 0.009 | 0.573 | (1;000) | ✗ | 05/01/17 |
BaMg4Ge3 | COD | 4322260 | P4/mmm (123) | ✔ | 8 | 62 | 3 | 0.0 | 0.005 | 0.308 | (0;001) | ✗ | 05/01/17 |
BaGe | ICSD | 659524 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.013 | 0.141 | (0;110) | ✗ | 05/01/17 |
BaMgGe | COD | 9008328 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 0.0 | 0.001 | 0.176 | (1;001) | ✗ | 05/01/17 |
BaMnGe | ICSD | 615891 | P4/nmm (129) | ✔ | 6 | 58 | 1 | 0.0 | 0.000 | 0.816 | (0;000) | ✗ | 05/01/17 |
BaMnGe | COD | 9008362 | P4/nmm (129) | ✔ | 6 | 58 | 1 | 0.0 | 0.000 | 0.812 | (0;001) | ✗ | 05/01/17 |
BaNi2Ge | ICSD | 421431 | Pmmn (59) | ✔ | 8 | 68 | 3 | 0.0 | 0.035 | 0.272 | (0;010) | ✗ | 05/01/17 |
BaGe(PO4)2 | ICSD | 423040 | C2/m (12) | ✔ | 12 | 72 | 2 | 4.6127 | 4.708 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaZnGe | COD | 1527801 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.018 | 0.282 | (0;000) | ✗ | 05/01/17 |
BaLiH3 | ICSD | 23977 | Pm-3m (221) | ✔ | 5 | 16 | 3 | 0.0 | 0.003 | 0.111 | (0;111) | ✗ | 05/01/17 |
BaLiH3 | ICSD | 416463 | Pm-3m (221) | ✔ | 5 | 16 | 1 | 2.2583 | 2.610 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaNaH3Pd | COD | 6000621 | P6_3/mmc (194) | ✔ | 12 | 80 | 1 | 1.5304 | 1.872 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaHf(PO4)2 | ICSD | 245690 | C2/m (12) | ✔ | 12 | 80 | 2 | 4.6342 | 4.701 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaHg2 | ICSD | 58655 | Imma (74) | ✔ | 6 | 68 | 3 | 0.0 | 0.037 | 0.399 | (0;111) | ✗ | 05/01/17 |
BaHg | ICSD | 58654 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.616 | (1;000) | ✗ | 05/01/17 |