▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BaSO4 | COD | 9004122 | Pnma (62) | ✔ | 24 | 160 | 1 | 6.3673 | 6.423 | 0.000 | (0;000) | ✗ | 04/08/17 |
BaSO4 | ICSD | 62368 | F-43m (216) | ✗ | 6 | 40 | 1 | 4.4829 | 4.488 | 0.000 | (0;000) | ✗ | 15/02/17 |
BAsO4 | ICSD | 413436 | P3_121 (152) | ✗ | 18 | 96 | 3 | 4.7353 | 4.824 | 0.000 | (0;000) | ✗ | 15/02/17 |
BAsO4 | ICSD | 413438 | I-4 (82) | ✗ | 6 | 32 | 3 | 5.1922 | 5.671 | 0.000 | (0;000) | ✗ | 06/10/16 |
BAsO4 | ICSD | 26891 | I-4 (82) | ✗ | 6 | 32 | 3 | 5.3758 | 5.789 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaSr2Mg(SiO4)2 | ICSD | 247861 | P-3m1 (164) | ✔ | 14 | 96 | 3 | 5.056 | 5.149 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaSr(FeO2)4 | ICSD | 1838 | P-31m (162) | ✔ | 14 | 100 | 2 | 0.0 | 0.017 | 0.796 | (0;001) | ✗ | 02/02/17 |
BaSr(FeO2)4 | ICSD | 2536 | P-6m2 (187) | ✗ | 14 | 100 | 3 | 0.0 | 0.000 | 0.839 | ? | ✗ | 21/03/17 |
BaTaS3 | COD | 4343774 | P6_3/mmc (194) | ✔ | 10 | 82 | 1 | 0.0 | 0.000 | 0.573 | (0;000) | ✗ | 02/02/17 |
BaTaSe3 | ICSD | 659547 | P6_3/mmc (194) | ✔ | 10 | 82 | 1 | 0.0 | 0.000 | 0.422 | (0;000) | ✗ | 02/02/17 |
BaTe | ICSD | 616162 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 0.4495 | 0.532 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaTe | COD | 9008602 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 1.2448 | 1.616 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaTe2 | ICSD | 80280 | I4/mcm (140) | ✔ | 6 | 44 | 1 | 0.3666 | 1.130 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaTe3 | ICSD | 36366 | P-42_1m (113) | ✗ | 8 | 56 | 1 | 0.719 | 0.730 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ba(TeMo)3 | ICSD | 603674 | P6_3/m (176) | ✔ | 14 | 140 | 3 | 0.0 | 0.001 | 0.674 | (1;000) | ✗ | 02/02/17 |
BaTeO3 | COD | 1524714 | P2_1/m (11) | ✔ | 10 | 68 | 1 | 2.8465 | 2.873 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba(TeO3)2 | ICSD | 8017 | Cmcm (63) | ✔ | 18 | 116 | 2 | 2.1918 | 2.567 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaTeS3 | ICSD | 8 | Pnma (62) | ✔ | 20 | 136 | 1 | 1.8106 | 2.025 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaTi2As2O | ICSD | 169074 | P4/mmm (123) | ✔ | 6 | 50 | 2 | 0.0 | 0.008 | 0.589 | (1;001) | ✗ | 05/01/17 |
BaTi2O5 | COD | 2310593 | C2/m (12) | ✔ | 24 | 192 | 3 | 0.0 | 0.006 | 0.420 | (1;000) | ✗ | 04/08/17 |
BaTi2O5 | COD | 2013673 | C2 (5) | ✗ | 24 | 192 | 3 | 2.2987 | 2.801 | 0.000 | (0;000) | ✗ | 04/08/17 |
BaTi(BO3)2 | ICSD | 97972 | R-3 (148) | ✔ | 10 | 64 | 2 | 2.6064 | 2.607 | 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 |
BaTiO3 | ICSD | 73641 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.1532 | 2.468 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73640 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.0864 | 2.362 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73639 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.0626 | 2.325 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73638 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.1635 | 2.478 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73637 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.1946 | 2.529 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73636 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3575 | 2.655 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73635 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3746 | 2.677 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73634 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3562 | 2.657 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73633 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4045 | 2.715 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73632 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3277 | 2.617 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73631 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4036 | 2.716 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73630 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4221 | 2.737 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73629 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3638 | 2.665 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 73628 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3799 | 2.685 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 6102 | R3m (160) | ✗ | 5 | 40 | 3 | 2.3587 | 2.658 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 31155 | C2mm (38) | ✗ | 5 | 40 | 3 | 1.9813 | 2.199 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 237109 | Cm2m (38) | ✗ | 5 | 40 | 3 | 1.7918 | 1.910 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 237106 | Cm2m (38) | ✗ | 5 | 40 | 3 | 1.9647 | 2.195 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 186463 | R3m (160) | ✗ | 5 | 40 | 3 | 2.5683 | 2.945 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 186462 | R3m (160) | ✗ | 5 | 40 | 3 | 2.5037 | 2.909 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 186461 | R3m (160) | ✗ | 5 | 40 | 3 | 2.0696 | 2.225 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 186460 | C2mm (38) | ✗ | 5 | 40 | 3 | 1.9349 | 2.048 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 161419 | C2mm (38) | ✗ | 5 | 40 | 3 | 0.0 | 0.012 | 0.481 | (0;000) | ✔ | 06/10/16 |
BaTiO3 | ICSD | 161341 | C2mm (38) | ✗ | 5 | 40 | 3 | 0.0 | 0.002 | 0.621 | (1;011) | ✔ | 06/10/16 |
BaTiO3 | ICSD | 154346 | C2mm (38) | ✗ | 5 | 40 | 3 | 0.0 | 0.012 | 0.529 | (0;110) | ✔ | 28/11/16 |
BaTiO3 | ICSD | 100464 | R3m (160) | ✗ | 5 | 40 | 3 | 2.2876 | 2.569 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | ICSD | 100463 | R3m (160) | ✗ | 5 | 40 | 3 | 2.2876 | 2.569 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTiO3 | COD | 5910149 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 1.8554 | 1.915 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaTiO3 | ICSD | 109327 | P4/mmm (123) | ✔ | 5 | 40 | 3 | 0.0 | 0.004 | 0.613 | (0;110) | ✗ | 05/01/17 |
BaTiS3 | COD | 2310546 | P6_3/mmc (194) | ✔ | 10 | 80 | 1 | 0.0 | 0.019 | 0.133 | (0;000) | ✗ | 02/02/17 |
BaTiS3 | ICSD | 18201 | Ccmm (63) | ✔ | 10 | 80 | 1 | 0.0 | 0.022 | 0.149 | (0;000) | ✗ | 06/10/16 |
BaTiSe3 | ICSD | 616131 | P6_3/mmc (194) | ✔ | 10 | 80 | 1 | 0.0 | 0.002 | 0.267 | (1;000) | ✗ | 02/02/17 |
BaTl2 | ICSD | 58681 | P6_3/mmc (194) | ✔ | 6 | 72 | 3 | 0.0 | 0.027 | 0.062 | (0;000) | ✗ | 05/01/17 |
Ba(TlHg)2 | COD | 4104570 | P4_2/mnm (136) | ✔ | 20 | 240 | 3 | 0.0 | 0.002 | 0.730 | (1;000) | ✗ | 21/03/17 |
BaV2Ni3(HO5)2 | ICSD | 424330 | C2/m (12) | ✔ | 18 | 128 | 2 | 0.0 | 0.006 | 0.659 | (0;000) | ✗ | 02/02/17 |
BaV2(NiO4)2 | COD | 2002114 | R-3 (148) | ✔ | 13 | 104 | 2 | 0.0154 | 0.027 | 0.000 | (0;111) | ✗ | 05/01/17 |
BaV3O8 | ICSD | 82063 | P2_1/m (11) | ✔ | 24 | 194 | 2 | 0.0 | 0.000 | 0.982 | (1;011) | ✗ | 04/08/17 |
BaVS3 | COD | 1008377 | P6_3/mmc (194) | ✔ | 10 | 82 | 3 | 0.0 | 0.000 | 0.675 | (1;000) | ✗ | 02/02/17 |
BaVS3 | COD | 1008062 | P6_3/mmc (194) | ✔ | 10 | 82 | 1 | 0.0 | 0.000 | 0.424 | (0;000) | ✗ | 02/02/17 |
BaVS3 | ICSD | 63230 | C222_1 (20) | ✗ | 10 | 82 | 1 | 0.0 | 0.001 | 0.388 | ? | ✗ | 06/10/16 |
BaVS3 | ICSD | 63229 | Ccm2_1 (36) | ✗ | 10 | 82 | 1 | 0.0 | 0.000 | 0.538 | ? | ✗ | 06/10/16 |
BaVS3 | ICSD | 616099 | Ccm2_1 (36) | ✗ | 10 | 82 | 1 | 0.0 | 0.000 | 0.542 | ? | ✗ | 06/10/16 |
BaVS3 | ICSD | 52692 | Ccm2_1 (36) | ✗ | 10 | 82 | 1 | 0.0 | 0.000 | 0.497 | ? | ✗ | 06/10/16 |
BaVS3 | ICSD | 154184 | Cm (8) | ✗ | 10 | 82 | 1 | 0.0 | 0.002 | 0.581 | ? | ✗ | 06/10/16 |
BaVS3 | ICSD | 154183 | Cm (8) | ✗ | 10 | 82 | 1 | 0.0 | 0.004 | 0.574 | ? | ✗ | 06/10/16 |
BaVS3 | ICSD | 154182 | Ccm2_1 (36) | ✗ | 10 | 82 | 1 | 0.0 | 0.000 | 0.545 | (0;011) | ✔ | 05/12/16 |
BaVSe3 | COD | 1521756 | P6_3/mmc (194) | ✔ | 10 | 82 | 1 | 0.0 | 0.000 | 0.358 | (0;000) | ✗ | 02/02/17 |
BaWO2 | COD | 5910071 | I4_1/a (88) | ✔ | 16 | 144 | 3 | 0.0 | 0.017 | 0.346 | (1;111) | ✗ | 02/02/17 |
BaWO4 | ICSD | 52384 | I4_1/a (88) | ✔ | 12 | 124 | 2 | 4.1591 | 4.294 | 0.000 | (0;000) | ✗ | 11/04/17 |
BaWO4 | ICSD | 155515 | Ccm2_1 (36) | ✗ | 12 | 96 | 2 | 0.0 | 0.175 | 1.000 | (0;000) | ✔ | 06/10/16 |
BaY2NiO5 | COD | 2002505 | Immm (71) | ✔ | 9 | 72 | 3 | 0.0 | 0.009 | 0.438 | (0;000) | ✗ | 05/01/17 |
BaY2PdO5 | COD | 1000242 | P4/mbm (127) | ✔ | 18 | 160 | 3 | 2.2474 | 2.377 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaYAgSe3 | ICSD | 104237 | Cmcm (63) | ✔ | 12 | 100 | 2 | 1.1764 | 1.489 | 0.000 | (0;000) | ✗ | 30/01/17 |
BaYAgTe3 | ICSD | 88717 | Cmcm (63) | ✔ | 12 | 100 | 1 | 0.4318 | 0.783 | 0.000 | (0;000) | ✗ | 30/01/17 |
BaYCuS3 | ICSD | 659166 | Cmcm (63) | ✔ | 12 | 100 | 2 | 1.3296 | 1.455 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaYCuSe3 | ICSD | 659169 | Cmcm (63) | ✔ | 12 | 100 | 2 | 1.0243 | 1.216 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaYCuTe3 | ICSD | 88716 | Cmcm (63) | ✔ | 12 | 100 | 2 | 0.2644 | 0.632 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaYFeCuO5 | ICSD | 71355 | P4mm (99) | ✗ | 9 | 70 | 3 | 0.0 | 0.001 | 0.784 | ? | ✗ | 15/02/17 |
BaYMn2O6 | ICSD | 154011 | C2/m (12) | ✔ | 20 | 174 | 3 | 0.0 | 0.004 | 0.750 | (0;001) | ✗ | 02/02/17 |
BaZn | ICSD | 616171 | Pm-3m (221) | ✔ | 2 | 22 | 1 | 0.0 | 0.000 | 0.663 | (1;000) | ✗ | 05/01/17 |
BaZn2 | ICSD | 58683 | Imma (74) | ✔ | 6 | 68 | 3 | 0.0 | 0.006 | 0.471 | (0;111) | ✗ | 05/01/17 |
BaZn5 | ICSD | 616174 | Cmcm (63) | ✔ | 12 | 140 | 3 | 0.0 | 0.005 | 0.532 | (1;110) | ✗ | 02/02/17 |
Ba(ZnAs)2 | COD | 7221354 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.1744 | 0.174 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ba(ZnAs)2 | ICSD | 417000 | I4/mmm (139) | ✔ | 5 | 44 | 2 | 0.0 | 0.099 | 0.151 | (0;000) | ✗ | 05/01/17 |
BaZnAsF | ICSD | 189936 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.1626 | 0.163 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaZnBi2 | ICSD | 58638 | I4/mmm (139) | ✔ | 8 | 104 | 1 | 0.0 | 0.043 | 0.147 | (0;000) | ✗ | 02/02/17 |
BaZnBO3F | ICSD | 248042 | P-6 (174) | ✗ | 7 | 50 | 3 | 3.7899 | 4.365 | 0.000 | (0;000) | ✗ | 15/02/17 |
BaZnCl4 | ICSD | 411952 | Pbcn (60) | ✔ | 24 | 200 | 1 | 4.6825 | 4.683 | 0.000 | (0;000) | ✗ | 04/08/17 |
BaZnCl4 | ICSD | 410194 | Pnna (52) | ✔ | 24 | 200 | 1 | 4.6929 | 4.693 | 0.000 | (0;000) | ✗ | 04/08/17 |
BaZnCO3F2 | COD | 1100122 | P6_3/m (176) | ✔ | 16 | 116 | 2 | 5.0322 | 5.038 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaZnF4 | ICSD | 182608 | Pc (7) | ✗ | 24 | 200 | 3 | 4.5419 | 4.639 | 0.000 | (0;000) | ✗ | 04/08/17 |
BaZnF4 | ICSD | 402926 | Ccm2_1 (36) | ✗ | 12 | 100 | 2 | 4.7142 | 4.744 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaZnF4 | ICSD | 402925 | Ccm2_1 (36) | ✗ | 12 | 100 | 2 | 4.6827 | 4.712 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaZnF4 | ICSD | 182609 | Ccm2_1 (36) | ✗ | 12 | 100 | 2 | 4.6699 | 4.690 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaZnF4 | ICSD | 182607 | Ccm2_1 (36) | ✗ | 12 | 100 | 2 | 4.5127 | 4.584 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaZnF4 | ICSD | 182606 | Ccm2_1 (36) | ✗ | 12 | 100 | 2 | 4.704 | 4.735 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaZnF4 | ICSD | 182605 | Ccm2_1 (36) | ✗ | 12 | 100 | 2 | 4.7095 | 4.712 | 0.000 | (0;000) | ✗ | 06/10/16 |