≤nAtoms≤
≤nElements≤
Space Group:
≤ Gap ≤
≤ Dir. Gap ≤
≤ Met. ≤
Formula
Composition
01ν2ν3)
Source ID

13628 materials founds

Formula Source ID space group centered nat ne dim gap dir. gap met. ν wcc updated
TiCl3 ICSD 38236 R-3 (148) 8 66 2 0.0 0.009 0.695 (0;000) 06/10/16
Al6Tc ICSD 58177 Cmcm (63) 14 66 3 0.0 0.000 1.000 (1;000) 30/01/17
Al6Re ICSD 58149 Cmcm (63) 14 66 3 0.0 0.000 0.578 (1;000) 30/01/17
Si2Mo ICSD 182116 P6_222 (180) 9 66 3 0.0485 0.512 0.000 (0;000) 06/10/16
VH2O3 ICSD 16727 C2/c (15) 12 66 2 0.0 0.000 0.336 (1;101) 27/01/17
Ca3ZnSe4 ICSD 167833 P-43m (215) 8 66 1 1.9339 2.000 0.000 (0;000) 06/10/16
CrSi2 ICSD 96026 P6_422 (181) 9 66 3 0.3265 0.494 0.000 (0;000) 06/10/16
CaSn(BO3)2 COD 9009324 R-3 (148) 10 66 2 4.1999 4.540 0.000 (0;000) 05/01/17
MgSn(BO3)2 ICSD 28266 R-3 (148) 10 66 3 2.8625 2.973 0.000 (0;000) 05/01/17
SrSn(BO3)2 ICSD 28267 R-3 (148) 10 66 2 2.234 2.378 0.000 (0;000) 05/01/17
CuGeO3 ICSD 16834 Pmcm (51) 10 66 3 0.0 0.000 0.683 (1;010) 06/10/16
BaCrF6 COD 1525278 R-3m (166) 8 66 1 0.0 0.000 0.174 (0;000) 05/01/17
P2O7F2 COD 2300034 P-1 (2) 11 66 1 0.0 0.005 0.667 (1;000) 27/01/17
BaPbF6 ICSD 25521 R-3m (166) 8 66 1 3.4266 3.427 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
AlPt3 ICSD 656679 I4/mcm (140) 8 66 3 0.0 0.001 0.579 (0;111) 30/01/17
AlPt3 ICSD 107439 P4/mbm (127) 8 66 3 0.0 0.000 0.715 (1;001) 30/01/17
Ba(P2Pd)2 ICSD 75020 I4/mmm (139) 7 66 2 0.0 0.025 0.332 (0;000) 05/01/17
TiPd3 COD 1522883 Pm-3m (221) 4 66 3 0.0 0.000 0.376 (1;111) 27/01/17
Be12Pd ICSD 109314 I4/mmm (139) 13 66 1 0.0 0.002 0.476 (1;000) 05/01/17
TiCdF6 COD 1527894 R-3 (148) 8 66 3 0.1564 0.162 0.000 (0;000) 27/01/17
MgPbF6 COD 1527518 R-3 (148) 8 66 3 2.8342 2.880 0.000 (0;000) 27/01/17
Cr3Se4 COD 1008921 C2/m (12) 7 66 3 0.0 0.004 0.716 (0;001) 27/01/17
HfBRh3 ICSD 614447 Pm-3m (221) 5 66 3 0.0451 0.109 0.000 (0;111) 05/01/17
CsBiF6 COD 1527499 R-3 (148) 8 66 1 4.0108 4.011 0.000 (0;000) 05/01/17
NaBiF6 COD 1527497 R-3 (148) 8 66 1 2.9849 3.074 0.000 (0;000) 05/01/17
RbBiF6 COD 1527498 R-3 (148) 8 66 1 4.8559 4.856 0.000 (0;000) 05/01/17
LiYGa4 ICSD 98666 P-6m2 (187) 6 66 3 0.0 0.004 0.244 (0;000) 05/12/16
ReO3 ICSD 202338 P6_322 (182) 8 66 3 0.0 0.001 0.569 (1;101) 06/10/16
BiPd COD 9004224 P6_3/mmc (194) 4 66 3 0.0 0.000 0.833 (1;000) 05/01/17
Mn2B COD 1511237 I4/mcm (140) 6 66 3 0.0 0.000 0.530 (1;111) 27/01/17
HgPb2(ClO)2 ICSD 74973 C2/m (12) 7 66 2 2.0457 2.198 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
Cr3S4 COD 9007442 C2/m (12) 7 66 3 0.0 0.005 0.538 (0;001) 27/01/17
NiPbF6 COD 1527520 R-3 (148) 8 66 3 0.0 0.011 0.396 (0;000) 27/01/17
Zr2CoSi2 ICSD 653752 C2/m (12) 10 66 3 0.0 0.009 0.595 (0;111) 27/01/17
NiSnF6 ICSD 25015 R-3 (148) 8 66 3 0.0 0.000 0.415 (0;000) 27/01/17
PtPbF6 ICSD 4057 R-3m (166) 8 66 3 1.7818 1.946 0.000 (0;000) 27/01/17
MgCd(CO3)2 COD 9000106 R-3 (148) 10 66 3 0.0 0.013 0.276 (1;111) 27/01/17
ScCrC2 ICSD 80373 P6_3/mmc (194) 8 66 3 0.0 0.000 0.951 (1;000) 27/01/17
CuH2C2BrN COD 7052608 P-1 (2) 14 66 3 0.8149 1.037 0.000 (0;000) 27/01/17
NbI2O ICSD 36255 C2 (5) 8 66 2 0.8298 0.837 0.000 (0;000) 06/10/16
Sc3CoC4 COD 2300492 Immm (71) 8 66 3 0.0 0.006 0.545 (1;111) 27/01/17
Sc3IrC4 ICSD 415137 Immm (71) 8 66 3 0.0 0.024 0.504 (1;111) 27/01/17
Sc3IrC4 ICSD 657402 Immm (71) 8 66 3 0.0 0.020 0.462 (1;111) 27/01/17
Sc3RhC4 ICSD 657400 Immm (71) 8 66 3 0.0 0.009 0.520 (1;111) 27/01/17
Li5ReO6 ICSD 74982 C2/m (12) 12 66 1 2.3121 2.393 0.000 (0;000) 27/01/17
CaCrF6 COD 1525280 R-3 (148) 8 66 1 0.0 0.021 0.350 (0;000) 27/01/17
GaNi2 ICSD 634869 P6_3/mmc (194) 6 66 3 0.0 0.000 0.978 (0;000) 27/01/17
Cr3Te4 ICSD 626873 C2/m (12) 7 66 2 0.0 0.012 0.181 (1;000) 27/01/17
Cr3Te4 ICSD 626884 C2/m (12) 7 66 3 0.0 0.009 0.299 (0;000) 27/01/17
TaPt2 ICSD 105802 Ccmm (63) 6 66 3 0.0 0.000 0.632 (1;110) 06/10/16
CaPbF6 ICSD 25522 Fm-3m (225) 8 66 3 3.1951 3.195 0.000 (0;000) 27/01/17
CaSnF6 ICSD 35713 Fm-3m (225) 8 66 1 6.1583 6.158 0.000 (0;000) 27/01/17
Cs2As3 ICSD 409382 Fmmm (69) 10 66 1 0.4415 0.442 0.000 (0;000) 30/01/17
Nb2AlC ICSD 606236 P6_3/mmc (194) 8 66 3 0.0 0.000 0.888 (1;000) 27/01/17
Ta2AlC ICSD 606258 P6_3/mmc (194) 8 66 3 0.0 0.000 0.900 (1;000) 27/01/17
AlV2C ICSD 606283 P6_3/mmc (194) 8 66 3 0.0 0.000 0.902 (1;000) 27/01/17
SrCuO2 COD 1525982 Cmcm (63) 8 66 3 0.0 0.000 0.961 (0;110) 27/01/17
SrCrF6 COD 1525279 R-3m (166) 8 66 1 0.0 0.002 0.180 (0;000) 27/01/17
Rb2As3 ICSD 409381 Fmmm (69) 10 66 1 0.3972 0.403 0.000 (0;000) 30/01/17
MgCrF6 COD 1525281 R-3 (148) 8 66 3 0.0 0.021 0.431 (0;000) 27/01/17
Si2W ICSD 652549 P6_222 (180) 9 66 3 0.0 0.481 0.083 (0;000) 06/10/16
ScRh3C ICSD 77385 Pm-3m (221) 5 66 3 0.0 0.000 0.137 (0;111) 27/01/17
TaPt2 COD 1523693 Cmcm (63) 6 66 3 0.0 0.000 0.632 (1;110) 27/01/17
VP4 ICSD 38315 C2/c (15) 10 66 2 0.0 0.000 0.729 (1;011) 27/01/17
ScZnPt ICSD 424600 Cmcm (63) 6 66 3 0.0 0.000 0.614 (0;110) 27/01/17
GeTe7As4 ICSD 41107 P-3m1 (164) 12 66 2 0.0 0.012 0.072 (1;001) 30/01/17
CrGa4 ICSD 626026 Im-3m (229) 5 66 3 0.0 0.000 0.153 (0;000) 27/01/17
CrSi2 ICSD 16836 P6_222 (180) 9 66 3 0.3285 0.492 0.000 (0;000) 06/10/16
YSi3Ni ICSD 9933 C2mm (38) 10 66 3 0.0 0.009 0.795 ? 06/10/16
ScIr3C ICSD 77044 Pm-3m (221) 5 66 3 0.0 0.012 0.378 (1;000) 27/01/17
SiCuO3 ICSD 89669 Pmma (51) 10 66 3 0.0 0.000 0.860 (0;100) 27/01/17
YRh3C ICSD 77389 Pm-3m (221) 5 66 3 0.0 0.000 0.259 (0;111) 27/01/17
Li(YSi)2 ICSD 8160 P4/mbm (127) 10 66 3 0.0 0.000 0.896 (1;111) 02/02/17
Cs2TeI6 ICSD 38105 Fm-3m (225) 9 66 2 1.0948 1.391 0.000 (0;000) 02/02/17
CsCo(CO)4 ICSD 31359 I-4 (82) 10 66 2 3.736 3.877 0.000 (0;000) 15/02/17
RbHg2 ICSD 408698 Imma (74) 6 66 3 0.0 0.000 0.587 (1;110) 02/02/17
AsS COD 4343657 Cmc2_1 (36) 12 66 1 0.0 0.000 0.732 ? 21/03/17
Sn(NCl3)2 COD 9015542 Fm-3m (225) 9 66 2 0.0 0.000 0.534 (1;000) 02/02/17
LiScAs2O7 ICSD 161499 C2 (5) 11 66 3 4.194 4.317 0.000 (0;000) 15/02/17
Rb2SeCl6 COD 1010221 Fm-3m (225) 9 66 1 2.4927 2.728 0.000 (0;000) 02/02/17
GeSb4Te7 ICSD 42875 P-3m1 (164) 12 66 2 0.056 0.111 0.000 (1;001) 02/02/17
Tl2SiHgSe4 ICSD 247763 I-42m (121) 8 66 3 0.5765 0.583 0.000 (0;000) 29/03/17
Rb2TeCl6 COD 1010232 Fm-3m (225) 9 66 2 2.5055 2.733 0.000 (0;000) 02/02/17
TlFeSe2 COD 1524708 C2/m (12) 8 66 2 0.0 0.016 0.372 (0;000) 02/02/17
Rb2TeBr6 ICSD 49522 Fm-3m (225) 9 66 2 1.8651 2.124 0.000 (0;000) 02/02/17
NaSi6 ICSD 237248 Cmcm (63) 14 66 3 0.0 0.000 0.792 (0;111) 02/02/17
H5(C2O)2 COD 4113701 P-1 (2) 22 66 1 2.693 2.728 0.000 (0;000) 04/08/17
Cs3O COD 1528149 P6_3/mcm (193) 8 66 1 0.0 0.000 0.699 (1;001) 02/02/17
K2P3 ICSD 33259 Fmmm (69) 10 66 1 0.6919 0.692 0.000 (0;000) 02/02/17
K5CuSb2 ICSD 32032 R-3m (166) 8 66 1 0.7123 0.859 0.000 (0;000) 02/02/17
Tl2CdGeTe4 COD 4000657 I-42m (121) 8 66 3 0.0 0.139 0.086 (0;000) 22/03/17
GaC5 COD 4110964 P-42c (112) 12 66 3 0.0 0.000 0.575 ? 21/03/17
H4C3N2Cl COD 2005472 C2/m (12) 20 66 1 2.2005 2.250 0.000 (0;000) 02/02/17
K2SeBr6 COD 1010627 Fm-3m (225) 9 66 2 1.6082 1.983 0.000 (0;000) 02/02/17
Tl2HgGeTe4 COD 4000659 I-42m (121) 8 66 3 0.0 0.076 0.127 (0;000) 11/04/17
SbTe ICSD 20459 P-3m1 (164) 12 66 2 0.0 0.110 0.056 (1;001) 02/02/17
Li2Sb COD 7221229 P-62c (190) 18 66 1 0.0 0.000 0.835 ? 29/03/17
Pb(NCl3)2 COD 9016622 Fm-3m (225) 9 66 2 0.0 0.000 0.548 (1;000) 02/02/17