▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▴ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Na3BiO4 | COD | 1525239 | P2/c (13) | ✔ | 16 | 132 | 1 | 1.329 | 1.347 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3Bi | COD | 1010291 | P6_3/mmc (194) | ✔ | 8 | 84 | 1 | 0.0 | 0.026 | 0.008 | (1;000) | ✗ | 02/02/17 |
Y5Ni2Bi | ICSD | 190147 | I4/mcm (140) | ✔ | 16 | 180 | 3 | 0.0 | 0.007 | 0.472 | (1;111) | ✗ | 02/02/17 |
NiBiO3 | COD | 7222310 | P-1 (2) | ✔ | 20 | 172 | 3 | 0.0 | 0.013 | 0.141 | (0;000) | ✗ | 02/02/17 |
BiRhO3 | ICSD | 188150 | Pnma (62) | ✔ | 20 | 200 | 3 | 0.4398 | 0.625 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrBiO3 | COD | 1008815 | P2_1/c (14) | ✔ | 20 | 172 | 3 | 0.4344 | 1.142 | 0.000 | (0;000) | ✗ | 02/02/17 |
VBiPbO5 | ICSD | 419122 | C2/m (12) | ✔ | 16 | 144 | 3 | 1.9715 | 2.258 | 0.000 | (0;000) | ✗ | 02/02/17 |
VBiPbO5 | ICSD | 56791 | P-1 (2) | ✔ | 16 | 144 | 3 | 2.2379 | 2.437 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiPPbO5 | ICSD | 419125 | P-1 (2) | ✔ | 16 | 128 | 3 | 1.6308 | 1.743 | 0.000 | (0;000) | ✗ | 02/02/17 |
Re2BiO6 | ICSD | 181425 | C2/c (15) | ✔ | 18 | 162 | 3 | 0.0 | 0.000 | 0.476 | (1;100) | ✗ | 02/02/17 |
Bi | COD | 9012437 | P6_3/mmc (194) | ✔ | 2 | 30 | 1 | 0.0 | 0.000 | 0.839 | (1;000) | ✗ | 02/02/17 |
BiOsSe | ICSD | 616892 | P2_1/c (14) | ✔ | 12 | 148 | 3 | 0.3781 | 0.641 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiPd3 | ICSD | 58839 | Pmma (51) | ✔ | 16 | 276 | 3 | 0.0 | 0.017 | 0.741 | (0;100) | ✗ | 02/02/17 |
BiPPb2 | COD | 1531358 | Pnma (62) | ✔ | 16 | 192 | 1 | 0.0 | 0.031 | 0.331 | (0;000) | ✗ | 02/02/17 |
Rb3Bi | ICSD | 616997 | P6_3/mmc (194) | ✔ | 8 | 84 | 1 | 0.0 | 0.005 | 0.053 | (0;000) | ✗ | 02/02/17 |
RbBi | ICSD | 9787 | Pmmn (59) | ✔ | 4 | 48 | 1 | 0.0 | 0.002 | 0.246 | (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 |
Sr2Bi | COD | 9008355 | I4/mmm (139) | ✔ | 6 | 70 | 1 | 0.0 | 0.033 | 0.051 | (0;111) | ✗ | 02/02/17 |
BiTe | COD | 9000678 | P-3m1 (164) | ✔ | 12 | 126 | 2 | 0.0457 | 0.097 | 0.000 | (0;001) | ✗ | 02/02/17 |
ZrBi | COD | 8100032 | Cmcm (63) | ✔ | 12 | 114 | 3 | 0.0 | 0.000 | 0.692 | (1;110) | ✗ | 02/02/17 |
K2NaBP2 | ICSD | 300133 | C2/m (12) | ✔ | 12 | 80 | 1 | 1.8181 | 1.907 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3BP2 | COD | 8103458 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.6994 | 2.098 | 0.000 | (0;000) | ✗ | 02/02/17 |
MnB | COD | 1511485 | P4_2/ncm (138) | ✔ | 16 | 144 | 3 | 0.0 | 0.001 | 0.588 | (0;000) | ✗ | 02/02/17 |
Na3BS3 | COD | 1511253 | C2/c (15) | ✔ | 14 | 96 | 1 | 2.5788 | 2.726 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb5Si3B | ICSD | 614916 | P6_3/mcm (193) | ✔ | 18 | 160 | 3 | 0.0 | 0.007 | 0.610 | (1;000) | ✗ | 02/02/17 |
NbBRu | COD | 4002175 | Pmma (51) | ✔ | 18 | 192 | 3 | 0.0 | 0.003 | 0.685 | (0;110) | ✗ | 02/02/17 |
Sr3BPO3 | ICSD | 401207 | P6_3/mmc (194) | ✔ | 16 | 112 | 1 | 2.106 | 2.352 | 0.000 | (0;000) | ✗ | 02/02/17 |
Tl3BO3 | COD | 1511279 | P6_3/m (176) | ✔ | 14 | 120 | 3 | 1.3717 | 1.560 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb3BP2 | COD | 8103471 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.6726 | 2.002 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y6NiBr10 | ICSD | 424466 | P-1 (2) | ✔ | 17 | 146 | 3 | 0.4074 | 0.493 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ta2Te4Br10O | ICSD | 401906 | P-1 (2) | ✔ | 17 | 126 | 2 | 0.9159 | 1.069 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y6PdBr10 | ICSD | 424467 | P-1 (2) | ✔ | 17 | 154 | 3 | 0.498 | 0.589 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sc7CoBr12 | ICSD | 424474 | R-3 (148) | ✔ | 20 | 178 | 3 | 0.1021 | 0.145 | 0.000 | (0;000) | ✗ | 02/02/17 |
Os(SeBr6)2 | ICSD | 182315 | C2/m (12) | ✔ | 15 | 112 | 2 | 0.2779 | 0.389 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSb2Se3Br2 | ICSD | 159464 | C2/m (12) | ✔ | 16 | 108 | 3 | 0.9933 | 1.005 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2Cu(BrCl)2 | ICSD | 15147 | Cmce (64) | ✔ | 14 | 114 | 2 | 0.0 | 0.000 | 0.824 | (0;000) | ✗ | 02/02/17 |
SbI3(BrCl3)2 | ICSD | 26404 | P-1 (2) | ✔ | 12 | 82 | 1 | 1.0807 | 1.099 | 0.000 | (0;000) | ✗ | 02/02/17 |
CoSb2Br2O3 | ICSD | 418858 | P-1 (2) | ✔ | 16 | 118 | 2 | 0.0 | 0.018 | 1.000 | (1;110) | ✗ | 02/02/17 |
ZnHg3Se3Br2 | ICSD | 186941 | P-3 (147) | ✔ | 18 | 160 | 3 | 0.0 | 0.002 | 0.589 | (0;000) | ✗ | 02/02/17 |
K4Br2O | ICSD | 68505 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 1.0113 | 1.011 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbLiBr2 | ICSD | 30719 | Cmcm (63) | ✔ | 8 | 52 | 1 | 4.3123 | 4.312 | 0.000 | (0;000) | ✗ | 02/02/17 |
Mg(BrO3)2 | COD | 9015252 | C2/m (12) | ✔ | 9 | 60 | 1 | 0.0 | 0.007 | 0.663 | (0;000) | ✗ | 02/02/17 |
MnBr2 | ICSD | 67517 | Fd-3m (227) | ✔ | 12 | 116 | 3 | 0.0 | 0.002 | 0.320 | (0;000) | ✗ | 02/02/17 |
Zn(BrN)2 | COD | 9016192 | Imma (74) | ✔ | 10 | 72 | 1 | 0.0 | 0.001 | 0.725 | (1;000) | ✗ | 02/02/17 |
VS2Br2N3 | ICSD | 61088 | P-1 (2) | ✔ | 16 | 108 | 1 | 0.633 | 0.645 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb(SBr)2 | ICSD | 424413 | P-1 (2) | ✔ | 10 | 78 | 2 | 1.4142 | 1.475 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb(SBr)2 | ICSD | 424414 | C2/m (12) | ✔ | 10 | 78 | 2 | 1.3148 | 1.325 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb(SeBr)2 | COD | 4030177 | P-1 (2) | ✔ | 10 | 78 | 2 | 0.0 | 0.066 | 0.211 | (1;001) | ✗ | 02/02/17 |
Nb(SeBr)2 | COD | 4030178 | C2/m (12) | ✔ | 10 | 78 | 2 | 0.7817 | 0.861 | 0.000 | (0;000) | ✗ | 02/02/17 |
Nb(SeBr)2 | COD | 4031460 | P-1 (2) | ✔ | 10 | 78 | 2 | 0.919 | 0.973 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb4Br2O | ICSD | 411954 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 0.6273 | 0.627 | 0.000 | (0;000) | ✗ | 02/02/17 |
PbBr2 | COD | 9009196 | Pnma (62) | ✔ | 12 | 112 | 2 | 2.537 | 2.640 | 0.000 | (0;000) | ✗ | 02/02/17 |
Pd(Se3Br)2 | ICSD | 418160 | P-1 (2) | ✔ | 9 | 68 | 2 | 0.7959 | 0.796 | 0.000 | (0;000) | ✗ | 02/02/17 |
SnBr2 | ICSD | 411177 | Pnma (62) | ✔ | 12 | 112 | 1 | 2.2341 | 2.269 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrBr2 | COD | 9009205 | Pnma (62) | ✔ | 12 | 96 | 1 | 3.4695 | 3.470 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrBr2 | ICSD | 41540 | R-3 (148) | ✔ | 18 | 108 | 3 | 0.0 | 0.043 | 0.050 | (0;000) | ✗ | 02/02/17 |
CaInBr3 | ICSD | 54138 | Cmcm (63) | ✔ | 10 | 88 | 1 | 3.0299 | 3.205 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsCdBr3 | COD | 1527655 | P6_3/mmc (194) | ✔ | 10 | 84 | 1 | 2.7458 | 2.746 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdInBr3 | ICSD | 79512 | Pnma (62) | ✔ | 20 | 184 | 2 | 2.0556 | 2.245 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbCdBr3 | ICSD | 808 | Pnma (62) | ✔ | 20 | 168 | 1 | 2.8691 | 2.929 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlCdBr3 | ICSD | 39808 | Pnma (62) | ✔ | 20 | 184 | 2 | 2.5394 | 2.711 | 0.000 | (0;000) | ✗ | 02/02/17 |
CrInBr3 | ICSD | 54136 | P2_1/c (14) | ✔ | 20 | 192 | 3 | 0.0 | 0.006 | 0.247 | (1;000) | ✗ | 02/02/17 |
CsCu2Br3 | ICSD | 150304 | Cmcm (63) | ✔ | 12 | 104 | 1 | 1.5921 | 1.592 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsFeBr3 | ICSD | 174041 | P6_3/mmc (194) | ✔ | 10 | 76 | 1 | 0.0 | 0.042 | 0.009 | (0;000) | ✗ | 02/02/17 |
CsBr3 | ICSD | 22130 | Pnma (62) | ✔ | 16 | 120 | 1 | 2.1955 | 2.251 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsMgBr3 | ICSD | 87260 | P6_3/mmc (194) | ✔ | 10 | 80 | 1 | 4.2366 | 4.237 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsMnBr3 | COD | 1532232 | P6_3/mmc (194) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.764 | (0;000) | ✗ | 02/02/17 |
CsNiBr3 | ICSD | 423829 | P6_3/mmc (194) | ✔ | 10 | 80 | 1 | 0.0 | 0.004 | 0.320 | (0;000) | ✗ | 02/02/17 |
CsPbBr3 | ICSD | 28312 | Pnma (62) | ✔ | 20 | 176 | 2 | 2.4002 | 2.502 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsPbBr3 | COD | 4510745 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.6539 | 0.654 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsTiBr3 | ICSD | 41320 | P6_3/mmc (194) | ✔ | 10 | 84 | 1 | 0.0 | 0.013 | 0.537 | (0;000) | ✗ | 02/02/17 |
CsVBr3 | COD | 1530067 | P6_3/mmc (194) | ✔ | 10 | 86 | 1 | 0.0 | 0.000 | 0.745 | (0;000) | ✗ | 02/02/17 |
RbCu2Br3 | ICSD | 150306 | Cmcm (63) | ✔ | 12 | 104 | 1 | 1.5398 | 1.540 | 0.000 | (0;000) | ✗ | 02/02/17 |
FeBr3 | ICSD | 410924 | R-3 (148) | ✔ | 8 | 58 | 2 | 0.0 | 0.010 | 0.479 | (0;000) | ✗ | 02/02/17 |
InFeBr3 | ICSD | 75469 | Pnma (62) | ✔ | 20 | 168 | 3 | 0.209 | 0.339 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlFeBr3 | ICSD | 36217 | Pnma (62) | ✔ | 20 | 168 | 1 | 0.2469 | 0.351 | 0.000 | (0;000) | ✗ | 02/02/17 |
GaBr3 | ICSD | 413456 | P2_1/c (14) | ✔ | 16 | 136 | 1 | 3.2077 | 3.208 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiGaBr3 | ICSD | 61338 | P2_1/m (11) | ✔ | 20 | 148 | 1 | 3.1198 | 3.120 | 0.000 | (0;000) | ✗ | 02/02/17 |
InBr3 | ICSD | 65198 | C2/m (12) | ✔ | 8 | 68 | 2 | 2.6722 | 2.697 | 0.000 | (0;000) | ✗ | 02/02/17 |
KInBr3 | ICSD | 50510 | P-3 (147) | ✔ | 20 | 172 | 1 | 2.4275 | 2.428 | 0.000 | (0;000) | ✗ | 02/02/17 |
MgInBr3 | ICSD | 402533 | Pnma (62) | ✔ | 20 | 176 | 3 | 1.8247 | 2.328 | 0.000 | (0;000) | ✗ | 02/02/17 |
MnInBr3 | ICSD | 75470 | Pnma (62) | ✔ | 20 | 196 | 3 | 0.0 | 0.000 | 0.208 | (0;011) | ✗ | 02/02/17 |
IrBr3 | COD | 1527188 | C2/m (12) | ✔ | 8 | 76 | 2 | 1.389 | 1.433 | 0.000 | (0;000) | ✗ | 02/02/17 |
Te6IrBr3 | ICSD | 423673 | R-3c (167) | ✔ | 20 | 148 | 3 | 0.729 | 1.004 | 0.000 | (0;000) | ✗ | 02/02/17 |
KMnBr3 | ICSD | 42441 | Pnma (62) | ✔ | 20 | 180 | 2 | 0.0 | 0.000 | 0.347 | (0;101) | ✗ | 02/02/17 |
Li6Br3N | ICSD | 84092 | P2_1/c (14) | ✔ | 20 | 88 | 1 | 2.3159 | 2.316 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbMnBr3 | COD | 1532234 | P6_3/mmc (194) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.748 | (0;000) | ✗ | 02/02/17 |
MoBr3 | COD | 1525597 | Cmcm (63) | ✔ | 8 | 70 | 1 | 0.0 | 0.000 | 0.463 | (0;110) | ✗ | 02/02/17 |
NbSeBr3 | ICSD | 75362 | P2/c (13) | ✔ | 20 | 160 | 1 | 0.6371 | 0.769 | 0.000 | (0;000) | ✗ | 02/02/17 |
NbSeBr3 | COD | 4030713 | P2/c (13) | ✔ | 20 | 160 | 1 | 0.0742 | 0.158 | 0.000 | (0;000) | ✗ | 02/02/17 |
NbTeBr3 | ICSD | 35376 | P2/c (13) | ✔ | 20 | 160 | 1 | 0.5241 | 0.644 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbNiBr3 | COD | 1527093 | P6_3/mmc (194) | ✔ | 10 | 80 | 1 | 0.0 | 0.014 | 0.320 | (0;000) | ✗ | 02/02/17 |
PBr3O | COD | 2106216 | Pnma (62) | ✔ | 20 | 128 | 1 | 3.3896 | 3.488 | 0.000 | (0;000) | ✗ | 02/02/17 |
PBr3 | ICSD | 8052 | Pnma (62) | ✔ | 16 | 104 | 1 | 3.1017 | 3.223 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbTiBr3 | ICSD | 154257 | P6_3/mmc (194) | ✔ | 10 | 84 | 1 | 0.0 | 0.017 | 0.528 | (0;000) | ✗ | 02/02/17 |
RbVBr3 | COD | 1530069 | P6_3/mmc (194) | ✔ | 10 | 86 | 1 | 0.0 | 0.000 | 0.658 | (0;000) | ✗ | 02/02/17 |
RhBr3 | ICSD | 28245 | C2/m (12) | ✔ | 8 | 76 | 2 | 1.23 | 1.361 | 0.000 | (0;000) | ✗ | 02/02/17 |
Te6RhBr3 | ICSD | 423669 | R-3c (167) | ✔ | 20 | 148 | 3 | 0.7889 | 0.927 | 0.000 | (0;000) | ✗ | 02/02/17 |
RuBr3 | COD | 4000456 | Pmmn (59) | ✔ | 16 | 148 | 1 | 0.0 | 0.128 | 0.380 | (0;000) | ✗ | 02/02/17 |
RuBr3 | COD | 4000457 | P6_3/mcm (193) | ✔ | 8 | 74 | 1 | 0.0 | 0.000 | 0.768 | (0;000) | ✗ | 02/02/17 |