▴ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BiPtSe | ICSD | 616991 | P2_13 (198) | ✗ | 12 | 124 | 3 | 0.0 | 0.000 | 0.649 | ? | ✗ | 21/03/17 |
BiRh | COD | 9008914 | P6_3/mmc (194) | ✔ | 4 | 64 | 3 | 0.0 | 0.008 | 0.572 | (0;000) | ✗ | 05/01/17 |
BiRh | ICSD | 109109 | P6_3/mmc (194) | ✔ | 4 | 44 | 3 | 0.0 | 0.010 | 0.572 | (0;000) | ✗ | 06/10/16 |
BiRhO3 | ICSD | 188150 | Pnma (62) | ✔ | 20 | 200 | 3 | 0.4398 | 0.625 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiRhS | ICSD | 617013 | P2_13 (198) | ✗ | 12 | 152 | 3 | 0.2752 | 0.801 | 0.000 | (0;000) | ✔ | 24/04/17 |
BiRhSe | ICSD | 617014 | P2_13 (198) | ✗ | 12 | 152 | 3 | 0.1987 | 0.640 | 0.000 | (0;000) | ✔ | 11/04/17 |
BIrPd | ICSD | 75030 | F2dd (43) | ✗ | 12 | 152 | 3 | 0.0 | 0.036 | 0.519 | (0;111) | ✔ | 05/12/16 |
BiSbO4 | ICSD | 35478 | C2/c (15) | ✔ | 12 | 88 | 3 | 2.6573 | 2.690 | 0.000 | (0;000) | ✗ | 05/01/17 |
BiSBr | ICSD | 31389 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.4144 | 1.467 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiSCl | COD | 8103601 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.2731 | 1.362 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiSe | ICSD | 617073 | P-3m1 (164) | ✔ | 12 | 126 | 2 | 0.0 | 0.114 | 0.007 | (0;001) | ✗ | 02/02/17 |
BiSe | ICSD | 20458 | P-3m1 (164) | ✔ | 12 | 66 | 2 | 0.0 | 0.063 | 0.011 | (0;001) | ✗ | 06/10/16 |
BiSe | ICSD | 72197 | F2mm (42) | ✗ | 4 | 42 | 2 | 0.0 | 0.033 | 0.537 | (1;110) | ✔ | 06/10/16 |
BiSeBr | ICSD | 76649 | Pnma (62) | ✔ | 12 | 112 | 1 | 0.595 | 0.788 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiSeCl | ICSD | 40862 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.2742 | 1.277 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiSeI | COD | 2010577 | Pnma (62) | ✔ | 12 | 112 | 1 | 0.8997 | 0.935 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiSI | ICSD | 25575 | Pnma (62) | ✔ | 12 | 112 | 1 | 0.8593 | 1.045 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiTe | COD | 9000678 | P-3m1 (164) | ✔ | 12 | 126 | 2 | 0.0457 | 0.097 | 0.000 | (0;001) | ✗ | 02/02/17 |
BiTe | ICSD | 100654 | P-3m1 (164) | ✔ | 12 | 126 | 2 | 0.0457 | 0.097 | 0.000 | (0;001) | ✗ | 06/10/16 |
Bi(TeBr2)2 | ICSD | 83806 | P-1 (2) | ✔ | 14 | 110 | 3 | 1.0464 | 1.099 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiTeCl | ICSD | 79362 | P6_3mc (186) | ✗ | 6 | 36 | 2 | 0.264 | 0.280 | 0.000 | (0;000) | ✔ | 06/10/16 |
BiTeI | ICSD | 79364 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.006 | (1;100) | ✔ | 06/10/16 |
BiTeI | ICSD | 74501 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.003 | 0.261 | (0;000) | ✔ | 06/10/16 |
BiTeI | ICSD | 263109 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.1819 | 0.182 | 0.000 | (0;000) | ✔ | 06/10/16 |
BiTeI | ICSD | 10500 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.255 | (0;000) | ✔ | 06/10/16 |
BiTePd | ICSD | 70060 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.727 | ? | ✗ | 06/10/16 |
BiTePt | ICSD | 42549 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.739 | ? | ✗ | 06/10/16 |
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 |
BMo | ICSD | 191907 | Cmcm (63) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.777 | (0;110) | ✗ | 06/10/16 |
BMo2 | COD | 1511240 | I4/mcm (140) | ✔ | 6 | 62 | 3 | 0.0 | 0.000 | 0.653 | (1;000) | ✗ | 27/01/17 |
BN | ICSD | 41486 | P6_3mc (186) | ✗ | 4 | 16 | 3 | 5.2311 | 8.408 | 0.000 | (0;000) | ✗ | 06/10/16 |
BN | ICSD | 162880 | Cc (9) | ✗ | 8 | 32 | 3 | 3.3515 | 4.168 | 0.000 | (0;000) | ✗ | 06/10/16 |
BN | ICSD | 162883 | P2_1/c (14) | ✔ | 8 | 32 | 2 | 3.1457 | 3.540 | 0.000 | (0;000) | ✗ | 06/10/16 |
BN | ICSD | 162877 | Cm (8) | ✗ | 8 | 32 | 3 | 1.5525 | 1.567 | 0.000 | (0;000) | ✗ | 06/10/16 |
BN | ICSD | 162874 | F-43m (216) | ✗ | 2 | 8 | 3 | 4.4968 | 8.945 | 0.000 | (0;000) | ✗ | 06/10/16 |
BN | COD | 1010602 | P-6m2 (187) | ✗ | 4 | 16 | 2 | 4.3937 | 4.522 | 0.000 | (0;000) | ✗ | 15/02/17 |
BN | COD | 2016173 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 4.1848 | 4.579 | 0.000 | (0;000) | ✗ | 27/01/17 |
BN | ICSD | 20946 | Fmm2 (42) | ✗ | 2 | 8 | 3 | 0.0 | 1.907 | 0.333 | (0;000) | ✔ | 15/02/17 |
BN | ICSD | 236992 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 4.2811 | 4.562 | 0.000 | (0;000) | ✗ | 27/01/17 |
BN | COD | 1010331 | P6/mmm (191) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.351 | (0;000) | ✗ | 27/01/17 |
BN | ICSD | 162876 | Pmnb (62) | ✔ | 8 | 32 | 3 | 5.9754 | 6.508 | 0.000 | (0;000) | ✗ | 06/10/16 |
BN | ICSD | 186248 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 3.5701 | 3.601 | 0.000 | (0;000) | ✗ | 27/01/17 |
BNCl2 | ICSD | 28168 | R3 (146) | ✗ | 12 | 66 | 1 | 2.288 | 2.326 | 0.000 | (0;000) | ✗ | 06/10/16 |
BNCl2 | ICSD | 27255 | R3 (146) | ✗ | 12 | 66 | 1 | 2.3231 | 2.367 | 0.000 | (0;000) | ✗ | 06/10/16 |
BNCl2 | ICSD | 14276 | R3 (146) | ✗ | 12 | 66 | 1 | 2.3764 | 2.454 | 0.000 | (0;000) | ✗ | 06/10/16 |
BNF4 | COD | 9015016 | Pnma (62) | ✔ | 24 | 144 | 1 | 0.0 | 0.005 | 0.482 | (0;000) | ✗ | 04/08/17 |
BP | ICSD | 615155 | P6_3mc (186) | ✗ | 4 | 16 | 1 | 1.5643 | 1.691 | 0.000 | (0;000) | ✗ | 06/10/16 |
BP | ICSD | 181291 | F-43m (216) | ✗ | 2 | 8 | 3 | 1.2188 | 3.369 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPd2 | COD | 1511294 | Pnnm (58) | ✔ | 6 | 78 | 3 | 0.0 | 0.000 | 0.880 | (1;010) | ✗ | 27/01/17 |
BPd2 | ICSD | 10487 | Pmnn (58) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.880 | (0;101) | ✗ | 06/10/16 |
BPd3 | COD | 1511295 | Pnma (62) | ✔ | 16 | 228 | 3 | 0.0 | 0.000 | 0.634 | (1;110) | ✗ | 27/01/17 |
BPO4 | COD | 8103470 | P3_121 (152) | ✗ | 18 | 96 | 3 | 7.469 | 7.603 | 0.000 | (0;000) | ✗ | 15/02/17 |
BPO4 | ICSD | 55083 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6318 | 7.848 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 55082 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.5989 | 7.822 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 413437 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.731 | 7.958 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 26890 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.4923 | 7.703 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150380 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6841 | 7.769 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150379 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6826 | 7.789 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150378 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6596 | 7.782 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150377 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.7013 | 7.833 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150376 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6811 | 7.826 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150375 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6708 | 7.835 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150374 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6752 | 7.855 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150373 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6292 | 7.819 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150372 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6086 | 7.820 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150371 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.5837 | 7.792 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPS4 | ICSD | 24618 | I222 (23) | ✗ | 6 | 32 | 1 | 1.1178 | 1.383 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPt | COD | 9008910 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.822 | (0;000) | ✗ | 27/01/17 |
BPt | COD | 1511304 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.556 | (1;000) | ✗ | 27/01/17 |
BPt2 | ICSD | 615207 | P6_3/mmc (194) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.880 | (0;001) | ✗ | 27/01/17 |
Br | COD | 9013118 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.7043 | 1.768 | 0.000 | (0;000) | ✗ | 27/01/17 |
Br | COD | 1512496 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.1847 | 1.185 | 0.000 | (0;000) | ✗ | 27/01/17 |
Br | COD | 1010096 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.8751 | 1.877 | 0.000 | (0;000) | ✗ | 02/02/17 |
Br2O | ICSD | 50198 | Pna2_1 (33) | ✗ | 12 | 80 | 2 | 1.0922 | 1.294 | 0.000 | (0;000) | ✗ | 21/03/17 |
BrCl | ICSD | 424850 | Cmc2_1 (36) | ✗ | 4 | 28 | 1 | 1.895 | 1.911 | 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 |
BRh | ICSD | 150732 | Cmcm (63) | ✔ | 4 | 40 | 3 | 0.0 | 0.061 | 0.223 | (1;000) | ✗ | 27/01/17 |
BRh2 | COD | 2310098 | Pnma (62) | ✔ | 12 | 148 | 3 | 0.0 | 0.001 | 0.753 | (1;011) | ✗ | 27/01/17 |
BrN | COD | 9015934 | Fm-3m (225) | ✔ | 2 | 12 | 1 | 0.0 | 0.067 | 0.688 | (0;000) | ✗ | 27/01/17 |
BrN | COD | 9016337 | Pm-3m (221) | ✔ | 2 | 12 | 1 | 0.0 | 0.007 | 0.619 | (0;000) | ✗ | 27/01/17 |
BrNO3 | ICSD | 407765 | P2_12_12_1 (19) | ✗ | 20 | 120 | 1 | 2.25 | 2.269 | 0.000 | (0;000) | ✗ | 21/03/17 |
BSb | ICSD | 184571 | F-43m (216) | ✗ | 2 | 8 | 3 | 0.6393 | 2.485 | 0.000 | (0;000) | ✗ | 06/10/16 |
BW | COD | 9008954 | I4_1/amd (141) | ✔ | 8 | 68 | 3 | 0.0 | 0.008 | 1.000 | (1;111) | ✗ | 21/03/17 |
BW | ICSD | 615689 | Cmcm (63) | ✔ | 4 | 62 | 3 | 0.0 | 0.000 | 0.723 | (0;110) | ✗ | 11/04/17 |
BW2 | COD | 1511333 | I4/mcm (140) | ✔ | 6 | 118 | 3 | 0.0 | 0.000 | 0.564 | (1;000) | ✗ | 11/04/17 |
C | COD | 9000046 | Fmmm (69) | ✔ | 2 | 8 | 2 | 0.0 | 0.005 | 0.011 | (0;110) | ✗ | 27/01/17 |
C | COD | 9012594 | R-3m (166) | ✔ | 14 | 56 | 3 | 4.4247 | 5.344 | 0.000 | (0;000) | ✗ | 22/03/17 |
C | COD | 9012241 | Im-3m (229) | ✔ | 8 | 32 | 3 | 2.5767 | 3.974 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 9011577 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.060 | (0;000) | ✗ | 27/01/17 |
C | COD | 1100003 | R-3m (166) | ✔ | 2 | 8 | 2 | 0.0479 | 0.048 | 0.000 | (0;111) | ✗ | 27/01/17 |
C | COD | 4313211 | Fm-3m (225) | ✔ | 1 | 4 | 1 | 0.0 | 0.005 | 0.580 | (0;000) | ✗ | 27/01/17 |
C | COD | 9012231 | Cmme (67) | ✔ | 8 | 32 | 2 | 0.0 | 0.009 | 0.643 | (0;001) | ✗ | 27/01/17 |
C | COD | 9012303 | Fd-3m (227) | ✔ | 2 | 8 | 3 | 4.1576 | 5.595 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 1512497 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.043 | (0;000) | ✗ | 27/01/17 |
C | COD | 9012242 | P6_3/mmc (194) | ✔ | 4 | 16 | 3 | 3.3976 | 4.784 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 9012593 | R-3m (166) | ✔ | 10 | 40 | 3 | 4.5247 | 5.260 | 0.000 | (0;000) | ✗ | 22/03/17 |
C | COD | 9012592 | P6_3/mmc (194) | ✔ | 16 | 64 | 3 | 4.3691 | 5.374 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 9014004 | P6/mmm (191) | ✔ | 10 | 40 | 3 | 0.5198 | 1.862 | 0.000 | (0;000) | ✗ | 27/01/17 |