≤nAtoms≤
≤nElements≤
Space Group:
≤ Gap ≤
≤ Dir. Gap ≤
≤ Met. ≤
Formula
Composition
(ν0,ν1ν2ν3)
Source ID

13628 materials founds

▹ Formula ▹ Source ▹ ID ▹ space group ▹ centered ▴ nat ▹ ne ▹ dim ▹ gap ▹ dir. gap ▹ met. ▹ ν wcc ▹ updated
HgH2NCl ICSD 92480 Pmma (51) ✔ 10 52 2 2.5214 2.604 0.000 (0;000) ✗ 27/01/17
Be4B COD 1511458 P4/nmm (129) ✔ 10 38 1 0.0 0.000 0.827 (0;001) ✗ 05/01/17
TiFeO3 ICSD 246515 R3c (161) ✗ 10 76 3 0.2475 0.296 0.000 (0;000) ✔ 06/10/16
TiFeO3 ICSD 79278 R3c (161) ✗ 10 76 3 0.5011 0.525 0.000 (0;000) ✗ 06/10/16
SrBiIO2 ICSD 97510 Cmcm (63) ✔ 10 88 1 2.5655 2.661 0.000 (0;000) ✗ 02/02/17
Sb2AsS2 COD 9001702 C2/m (12) ✔ 10 54 3 0.1714 0.253 0.000 (0;000) ✗ 30/01/17
CrBO3 COD 2310093 R-3c (167) ✔ 10 70 3 0.0 0.000 0.476 (0;000) ✗ 05/01/17
Ca(BeGe)2 ICSD 25337 P4/nmm (129) ✔ 10 52 1 0.0 0.012 0.450 (1;000) ✗ 05/01/17
Ca(BeN)2 ICSD 413357 I4/mcm (140) ✔ 10 56 1 2.5333 2.668 0.000 (0;000) ✗ 05/01/17
FePSe3 ICSD 16246 R3 (146) ✗ 10 62 2 0.1664 0.212 0.000 (0;000) ✔ 06/10/16
Sr(BeN)2 ICSD 413356 I4/mcm (140) ✔ 10 56 1 1.993 2.104 0.000 (0;000) ✗ 05/01/17
Be2Nb3 ICSD 58722 P4/mbm (127) ✔ 10 94 3 0.0 0.000 0.950 (1;110) ✗ 05/01/17
InGaS3 ICSD 62340 Ccm2_1 (36) ✗ 10 88 2 1.6062 1.706 0.000 (0;000) ✗ 06/10/16
Ta3Be2 ICSD 616431 P4/mbm (127) ✔ 10 94 3 0.0 0.000 0.935 (0;001) ✗ 05/01/17
Sr2MgMoO6 ICSD 187662 I4/m (87) ✔ 10 80 3 2.1556 2.197 0.000 (0;000) ✗ 27/01/17
CuGeO3 COD 1528527 Pmma (51) ✔ 10 66 3 0.0 0.000 0.683 (1;010) ✗ 27/01/17
Be3N2 ICSD 25656 P6_3/mmc (194) ✔ 10 44 1 3.3628 4.793 0.000 (0;000) ✗ 02/02/17
MgSiO3 COD 9003749 R-3 (148) ✔ 10 64 3 6.2344 6.351 0.000 (0;000) ✗ 27/01/17
MgVO3 COD 1527260 Cmmm (65) ✔ 10 82 3 0.0 0.002 0.420 (0;001) ✗ 27/01/17
MgSiO3 COD 9009217 Cmcm (63) ✔ 10 64 3 8.0915 8.450 0.000 (0;000) ✗ 27/01/17
CsAuBr3 COD 2206091 I4/mmm (139) ✔ 10 82 3 0.8304 0.848 0.000 (0;000) ✗ 30/01/17
MnNiO3 ICSD 31853 R-3 (148) ✔ 10 86 3 0.0 0.012 0.447 (0;000) ✗ 27/01/17
Nb3Ga2 COD 1523839 P4/mbm (127) ✔ 10 130 3 0.0 0.000 0.851 (0;000) ✗ 27/01/17
Ga2O3 ICSD 27431 R-3c (167) ✔ 10 88 3 2.8601 3.106 0.000 (0;000) ✗ 27/01/17
Sr2YSbO6 ICSD 157886 Fm-3m (225) ✔ 10 72 3 3.803 3.803 0.000 (0;000) ✗ 27/01/17
Sr(SnAu)2 ICSD 427711 P4/nmm (129) ✔ 10 120 3 0.0 0.020 0.869 (1;000) ✗ 30/01/17
Cu(ClO)2 COD 9014996 Pmna (53) ✔ 10 74 2 0.0 0.000 0.938 (0;000) ✗ 02/02/17
Ba(SbAu)2 ICSD 416298 P2_1/m (11) ✔ 10 84 3 0.0 0.024 0.423 (1;000) ✗ 30/01/17
Ba(SnAu)2 COD 4338536 P4/nmm (129) ✔ 10 120 3 0.0 0.012 0.854 (0;000) ✗ 30/01/17
Hg2PCl2 ICSD 50594 C2/m (12) ✔ 10 86 3 1.5841 2.163 0.000 (0;000) ✗ 02/02/17
FeBO3 COD 1511131 R-3c (167) ✔ 10 58 3 0.0 0.001 0.646 (0;000) ✗ 05/01/17
Sr2YReO6 ICSD 25404 Fm-3m (225) ✔ 10 82 3 0.0 0.000 0.584 (0;000) ✗ 27/01/17
Ta(ICl)2 ICSD 69688 Immm (71) ✔ 10 82 1 0.9886 0.996 0.000 (0;000) ✗ 02/02/17
Y2InAu2 ICSD 658835 P4/mbm (127) ✔ 10 114 3 0.0 0.000 0.949 (0;001) ✗ 30/01/17
MgTe(PbO3)2 COD 1008899 Fm-3m (225) ✔ 10 80 3 2.7142 2.714 0.000 (0;000) ✗ 27/01/17
GaBO3 COD 1520321 R-3c (167) ✔ 10 68 3 4.3438 4.344 0.000 (0;000) ✗ 05/01/17
Pt(NCl)2 COD 9014307 P4/m (83) ✔ 10 68 3 0.0 0.009 0.422 (1;000) ✗ 02/02/17
Zn(NCl)2 COD 9015876 Imma (74) ✔ 10 72 1 0.0 0.000 0.771 (1;000) ✗ 02/02/17
Sr2ZrTiO6 ICSD 190548 I4/m (87) ✔ 10 72 3 2.6501 2.673 0.000 (0;000) ✗ 27/01/17
Sc2InAu2 ICSD 130040 P4/mbm (127) ✔ 10 114 3 0.0 0.000 0.990 (1;001) ✗ 30/01/17
Sr(GaAu)2 ICSD 370004 P4/nmm (129) ✔ 10 116 3 0.0 0.065 0.842 (0;000) ✗ 30/01/17
Sr2YTaO6 ICSD 247458 Fm-3m (225) ✔ 10 80 3 3.5326 3.533 0.000 (0;000) ✗ 27/01/17
Nb(SCl)2 COD 1522781 C2/m (12) ✔ 10 78 2 1.4336 1.434 0.000 (0;000) ✗ 02/02/17
Nb(SeCl)2 COD 1522780 P-1 (2) ✔ 10 78 2 0.9448 1.031 0.000 (0;000) ✗ 02/02/17
Ca2PbAu2 COD 8100914 P4/mbm (127) ✔ 10 112 3 0.0 0.021 0.638 (1;000) ✗ 30/01/17
Hf2InAu2 ICSD 130042 P4/mbm (127) ✔ 10 118 3 0.0 0.000 0.997 (1;001) ✗ 30/01/17
Mg(PtO2)3 ICSD 35340 Cmmm (65) ✔ 10 76 3 0.3278 0.359 0.000 (0;000) ✗ 27/01/17
Sc2SnAu2 ICSD 130046 P4/mbm (127) ✔ 10 116 3 0.0 0.005 0.892 (0;001) ✗ 30/01/17
P2PbAu2 COD 1510454 Cmcm (63) ✔ 10 92 3 0.0 0.049 0.610 (0;000) ✗ 30/01/17
Sr2ZnWO6 ICSD 28599 Fm-3m (225) ✔ 10 82 3 0.0 0.128 0.064 (0;000) ✗ 27/01/17
Zr2InAu2 ICSD 130041 P4/mbm (127) ✔ 10 86 3 0.0 0.000 0.983 (1;001) ✗ 30/01/17
MgPb2WO6 ICSD 262284 Fm-3m (225) ✔ 10 88 3 2.3897 2.412 0.000 (0;000) ✗ 27/01/17
Bi2SO2 ICSD 29451 Pnnm (58) ✔ 10 96 3 0.5844 0.953 0.000 (0;000) ✗ 05/01/17
Bi2O3 COD 1010311 Pn-3m (224) ✔ 10 96 3 0.0 0.003 0.667 (1;000) ✗ 05/01/17
Sr2MgWO6 ICSD 152575 Fm-3m (225) ✔ 10 80 3 2.6761 2.676 0.000 (0;000) ✗ 27/01/17
Sr2MgTeO6 ICSD 290893 C2/m (12) ✔ 10 72 3 2.8585 2.859 0.000 (0;000) ✗ 27/01/17
CaBiClO2 ICSD 84635 P2_1/m (11) ✔ 10 88 1 3.3755 3.652 0.000 (0;000) ✗ 05/01/17
CdBiClO2 COD 2012362 P2_1/m (11) ✔ 10 92 3 2.8582 3.016 0.000 (0;000) ✗ 05/01/17
BiPbClO2 COD 9012425 Cmcm (63) ✔ 10 96 2 1.7889 1.813 0.000 (0;000) ✗ 05/01/17
SrBiClO2 ICSD 84636 Cmcm (63) ✔ 10 88 1 3.1208 3.196 0.000 (0;000) ✗ 05/01/17
MgP4 COD 1528274 P2_1/c (14) ✔ 10 60 1 0.6681 0.668 0.000 (0;000) ✗ 27/01/17
Rb3Au7 COD 7209422 Cmmm (65) ✔ 10 104 3 0.0 0.045 0.348 (1;111) ✗ 30/01/17
SrGeAu3 COD 4117647 P4/nmm (129) ✔ 10 94 3 0.0 0.000 0.813 (1;000) ✗ 30/01/17
RbCrCl3 ICSD 2225 C2/m (12) ✔ 10 88 1 0.0 0.008 0.538 (0;000) ✗ 02/02/17
Cs2NaBiF6 ICSD 9382 Fm-3m (225) ✔ 10 84 1 3.9382 4.363 0.000 (0;000) ✗ 05/01/17
Y3Au2 COD 2018283 P4/mbm (127) ✔ 10 110 3 0.0 0.000 0.922 (0;001) ✗ 30/01/17
CsFeCl3 ICSD 300249 P6_3/mmc (194) ✔ 10 76 1 0.0943 0.094 0.000 (0;000) ✗ 02/02/17
CsMgCl3 ICSD 54167 P6_3/mmc (194) ✔ 10 80 1 5.3995 5.400 0.000 (0;000) ✗ 02/02/17
CsNiCl3 COD 2007344 P6_3/mmc (194) ✔ 10 80 1 0.0 0.002 0.203 (0;000) ✗ 02/02/17
CsScCl3 COD 4343633 P6_3/mmc (194) ✔ 10 82 1 0.0 0.000 0.596 (0;000) ✗ 02/02/17
Rb3Au7 COD 1510588 Cmmm (65) ✔ 10 104 3 0.0 0.047 0.290 (0;110) ✗ 30/01/17
CsTiCl3 ICSD 49748 P6_3/mmc (194) ✔ 10 84 1 0.0 0.001 0.511 (0;000) ✗ 02/02/17
CsVCl3 COD 1527869 P6_3/mmc (194) ✔ 10 86 1 0.0 0.000 0.717 (0;000) ✗ 02/02/17
Rb2NaBiF6 ICSD 9386 Fm-3m (225) ✔ 10 84 1 4.1294 4.307 0.000 (0;000) ✗ 05/01/17
CdP4 ICSD 25605 P2_1/c (14) ✔ 10 64 2 0.4602 0.528 0.000 (0;000) ✔ 06/10/16
RbCuCl3 ICSD 84212 P6_3/mmc (194) ✔ 10 82 1 0.0 0.000 0.655 (0;000) ✗ 02/02/17
RbAuBr3 COD 1510367 C2/m (12) ✔ 10 82 1 0.7922 0.849 0.000 (0;000) ✗ 30/01/17
MnP4 ICSD 100786 P-1 (2) ✔ 10 70 3 0.3988 0.496 0.000 (0;000) ✗ 06/10/16
RbGeCl3 COD 7221358 P2_1/m (11) ✔ 10 68 1 3.6922 3.704 0.000 (0;000) ✗ 02/02/17
CsCdAuS2 ICSD 85581 Cmme (67) ✔ 10 88 2 2.1236 2.236 0.000 (0;000) ✗ 30/01/17
NaBiO3 COD 1526788 R-3 (148) ✔ 10 84 1 1.4476 1.542 0.000 (0;000) ✗ 05/01/17
InBO3 COD 2010257 R-3c (167) ✔ 10 68 3 3.0882 3.509 0.000 (0;000) ✗ 05/01/17
SrBiO3 COD 2000656 Cmcm (63) ✔ 10 86 1 0.0 0.000 0.951 (1;110) ✗ 05/01/17
Cs3AuO COD 1510109 P6_3/mmc (194) ✔ 10 88 1 1.5275 1.528 0.000 (0;000) ✗ 30/01/17
ZnGeO3 ICSD 183725 R3c (161) ✗ 10 68 3 0.6709 0.671 0.000 (0;000) ✗ 06/10/16
P4Os ICSD 647708 P2_1/c (14) ✔ 10 72 3 1.1626 1.319 0.000 (0;000) ✗ 27/01/17
SiCuO3 ICSD 89669 Pmma (51) ✔ 10 66 3 0.0 0.000 0.860 (0;100) ✗ 27/01/17
NaBPt3 COD 1511249 P6/mmm (191) ✔ 10 84 3 0.0 0.039 0.685 (1;000) ✗ 27/01/17
Ge2N2O ICSD 169121 Cmc2_1 (36) ✗ 10 48 3 4.0068 4.143 0.000 (0;000) ✗ 06/10/16
NaMnCl3 ICSD 2552 R-3 (148) ✔ 10 90 1 0.0 0.001 0.730 (1;000) ✗ 02/02/17
VCuO3 COD 1530636 R-3 (148) ✔ 10 84 3 0.6355 0.683 0.000 (0;000) ✗ 27/01/17
Ge2N2O ICSD 200839 Cmc2_1 (36) ✗ 10 48 3 2.9473 3.241 0.000 (0;000) ✗ 06/10/16
ScBO3 COD 2018876 R-3c (167) ✔ 10 64 3 4.2967 4.297 0.000 (0;000) ✗ 27/01/17
TiBO3 COD 8103469 R-3c (167) ✔ 10 66 3 0.0 0.000 0.815 (0;000) ✗ 27/01/17
Ge2N2O ICSD 200840 Cmc2_1 (36) ✗ 10 48 3 3.0994 3.406 0.000 (0;000) ✗ 06/10/16
VBO3 COD 7209472 R-3c (167) ✔ 10 68 3 0.0 0.007 0.763 (0;000) ✗ 27/01/17
Ge2N2O ICSD 200841 Cmc2_1 (36) ✗ 10 48 3 3.0081 3.306 0.000 (0;000) ✗ 06/10/16
Si2N2O ICSD 200247 Cmc2_1 (36) ✗ 10 48 3 5.3458 5.346 0.000 (0;000) ✗ 06/10/16
Ge2N2O ICSD 200842 Cmc2_1 (36) ✗ 10 48 3 2.9053 3.235 0.000 (0;000) ✗ 06/10/16
RbNiCl3 COD 1527092 P6_3/mmc (194) ✔ 10 80 1 0.0 0.003 0.206 (0;000) ✗ 02/02/17