≤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
Cu2Sb COD 9008317 P4/nmm (129) 6 54 3 0.0 0.000 0.769 (0;000) 27/01/17
CuO2 ICSD 150913 Ccmm (63) 6 46 1 0.0 0.000 0.927 (0;110) 06/10/16
CuS2 ICSD 628782 Pnnm (58) 6 46 3 0.0 0.000 0.970 (0;110) 27/01/17
CsK2CoO2 ICSD 74889 I4/mmm (139) 6 56 1 0.0 0.066 0.476 (0;000) 27/01/17
KAuSe COD 1510205 Cmcm (63) 6 52 1 1.7302 2.008 0.000 (0;000) 05/01/17
KAuS COD 1510204 Cmcm (63) 6 52 1 1.8981 2.104 0.000 (0;000) 05/01/17
Te2Ir COD 1526500 P4_2/mnm (136) 6 58 3 0.0 0.000 0.870 (0;111) 27/01/17
KTeAu COD 1510208 P6_3/mmc (194) 6 52 2 0.0 0.002 0.029 (1;000) 05/01/17
CuSe2 ICSD 242 Pmnn (58) 6 46 3 0.0 0.000 0.939 (0;000) 06/10/16
LiSnAu COD 7209391 P6_3/mmc (194) 6 56 3 0.0 0.021 0.553 (0;000) 05/01/17
CN2 ICSD 247680 Cmc2_1 (36) 6 28 3 1.1333 1.133 0.000 (0;000) 06/10/16
Na2Au COD 1510247 I4/mcm (140) 6 58 1 0.0 0.003 0.723 (1;000) 05/01/17
NaTeAu COD 1510246 P6_3/mmc (194) 6 52 2 0.0 0.001 0.028 (1;000) 05/01/17
SrCu2O3 ICSD 416903 Cmmm (65) 6 50 3 0.0 0.005 0.916 (0;000) 27/01/17
TiCu2 ICSD 629379 Ccmm (63) 6 68 3 0.0 0.012 0.073 (1;000) 06/10/16
Zr2Ir ICSD 641204 I4/mcm (140) 6 50 3 0.0 0.000 0.574 (1;111) 27/01/17
Pb2Au COD 1510272 I4/mcm (140) 6 78 3 0.0 0.001 0.588 (0;111) 05/01/17
RbAuSe COD 8103428 Cmcm (63) 6 52 1 1.6696 1.949 0.000 (0;000) 05/01/17
Cu2O COD 9007497 Pn-3m (224) 6 56 3 0.4484 0.448 0.000 (0;000) 27/01/17
RbTeAu COD 1510282 P6_3/mmc (194) 6 52 2 0.0 0.008 0.015 (0;000) 05/01/17
RbAuS COD 1510281 Cmcm (63) 6 52 1 1.8414 2.060 0.000 (0;000) 05/01/17
ZrCu2 ICSD 191405 Cmcm (63) 6 68 3 0.0 0.010 0.168 (1;000) 06/10/16
SrSbAu COD 1510286 P6_3/mmc (194) 6 52 3 0.0 0.000 0.446 (0;000) 05/01/17
ZnCl2 ICSD 26152 P4_2/nmc (137) 6 52 2 3.8088 3.809 0.000 (0;000) 27/01/17
TaN ICSD 644712 P-62m (189) 6 54 3 0.0 0.000 0.289 (0;100) 06/10/16
Tl2Au COD 1510315 I4/mcm (140) 6 74 3 0.0 0.002 0.689 (1;111) 05/01/17
CaSnHg ICSD 602726 P6_3mc (186) 6 72 3 0.0 0.049 0.221 (0;000) 28/10/16
TaN ICSD 644729 Cm2m (38) 6 54 3 0.0 0.000 0.288 (1;100) 06/10/16
CO2 ICSD 188890 I-42d (122) 6 32 3 7.0217 7.119 0.000 (0;000) 06/10/16
CaZnSn ICSD 106358 P6_3mc (186) 6 72 3 0.0 0.030 0.241 (0;000) 06/10/16
MgF2 ICSD 191439 Pmnn (58) 6 48 3 7.9375 7.938 0.000 (0;000) 06/10/16
ScCo3B2 COD 1510622 P6/mmm (191) 6 68 3 0.0 0.004 0.449 (0;000) 05/01/17
YCo3B2 COD 1510628 P6/mmm (191) 6 68 3 0.0 0.001 0.504 (1;001) 05/01/17
MgF2 ICSD 51243 P-1 (2) 6 48 1 0.7823 1.004 0.000 (0;000) 06/10/16
PdCl2 COD 1010447 Pnnm (58) 6 64 1 0.7905 1.217 0.000 (0;000) 27/01/17
NiF2 ICSD 34307 Pmnn (58) 6 48 3 0.0 0.017 0.293 (0;000) 06/10/16
Cu2S ICSD 166578 P6_3/mmc (194) 6 56 3 0.0 0.031 0.151 (0;000) 27/01/17
ScB2Ir3 ICSD 614561 Cmmm (65) 6 68 3 0.0 0.011 0.364 (1;001) 05/01/17
YB2Ir3 COD 1510727 Cmmm (65) 6 68 3 0.0 0.015 0.380 (1;001) 05/01/17
YCu2 COD 2310298 Imma (74) 6 66 3 0.0 0.001 0.694 (0;100) 27/01/17
FeP2 ICSD 15027 Pmnn (58) 6 36 3 0.4006 0.861 0.000 (0;000) 06/10/16
B2Mo ICSD 167732 R-3m (166) 6 40 3 0.0 0.020 0.604 (0;111) 05/01/17
NbAs2 ICSD 81218 C2/m (12) 6 46 3 0.0 0.025 0.093 (0;100) 04/10/16
KLiSe ICSD 67277 P4/nmm (129) 6 36 1 2.4508 2.488 0.000 (0;000) 27/01/17
KLiTe ICSD 67887 P4/nmm (129) 6 36 1 2.2329 2.233 0.000 (0;000) 27/01/17
KMgP ICSD 641231 P4/nmm (129) 6 48 1 1.6702 1.715 0.000 (0;000) 27/01/17
KMgSb COD 9008327 P4/nmm (129) 6 48 1 1.0987 1.115 0.000 (0;000) 27/01/17
FeS2 ICSD 42415 Pmnn (58) 6 40 3 0.8069 1.148 0.000 (0;000) 06/10/16
KMnP COD 1521902 P4/nmm (129) 6 58 1 0.0 0.000 0.821 (1;000) 27/01/17
KMnSb COD 1521901 P4/nmm (129) 6 58 1 0.0 0.000 0.824 (1;000) 27/01/17
B2Os COD 1510804 Pmmn (59) 6 44 3 0.0 0.175 0.368 (0;010) 05/01/17
TiCu2 ICSD 629405 Cmcm (63) 6 68 3 0.0 0.022 0.085 (1;000) 27/01/17
FeSb2 ICSD 151397 Pmnn (58) 6 36 3 0.1637 0.361 0.000 (0;000) 06/10/16
ReB2 COD 2310090 P6_3/mmc (194) 6 42 3 0.0 0.000 0.613 (1;000) 05/01/17
KNaO ICSD 32743 P4/nmm (129) 6 48 1 2.318 2.413 0.000 (0;000) 27/01/17
YB2Rh3 ICSD 615340 Cmmm (65) 6 68 3 0.0 0.013 0.452 (0;000) 05/01/17
CoF2 COD 9009073 P4_2/mnm (136) 6 62 3 0.0 0.000 0.698 (0;000) 27/01/17
B2Ru COD 1510818 Pmmn (59) 6 44 3 0.0 0.059 0.376 (0;010) 05/01/17
ScB2 ICSD 106903 Fd-3m (227) 6 34 3 0.0 0.000 0.545 (0;000) 05/01/17
Cu2Te ICSD 77055 P6/mmm (191) 6 56 3 0.0 0.006 0.376 (0;000) 27/01/17
FeSe2 ICSD 25680 Pmnn (58) 6 40 3 0.2853 0.828 0.000 (0;000) 06/10/16
TcB2 ICSD 615553 P6_3/mmc (194) 6 42 3 0.0 0.000 0.686 (1;000) 05/01/17
FeTe2 ICSD 86518 Pmnn (58) 6 40 3 0.0 0.691 0.013 (0;000) 06/10/16
Li2Ga ICSD 100051 Cmcm (63) 6 38 1 0.0 0.000 0.778 (1;110) 06/10/16
CdAs2 ICSD 16037 I4_122 (98) 6 44 3 0.2887 0.909 0.000 (0;000) 06/10/16
CaSb2 ICSD 862 P2_1/m (11) 6 40 1 0.0 0.070 0.251 (1;011) 27/01/17
Ga2Os ICSD 103785 Fddd (70) 6 84 3 0.5627 0.794 0.000 (0;000) 06/10/16
ReN2 ICSD 187441 C2/m (12) 6 50 3 0.0 0.405 0.171 (0;000) 06/10/16
Ga2Ru ICSD 635227 Fddd (70) 6 84 3 0.2122 0.894 0.000 (0;000) 06/10/16
ScGa2 ICSD 103956 Cmmm (65) 6 74 3 0.0 0.017 0.510 (1;001) 06/10/16
KZnP COD 7221374 P6_3/mmc (194) 6 52 2 0.9058 0.906 0.000 (0;000) 27/01/17
Ba2CuBrO2 COD 2002478 R-3m (166) 6 50 2 2.3456 2.346 0.000 (0;000) 05/01/17
Ba2H3Br ICSD 415127 P-3m1 (164) 6 30 1 2.0033 2.374 0.000 (0;000) 05/01/17
KZnSb COD 7221375 P6_3/mmc (194) 6 52 2 0.3531 0.353 0.000 (0;000) 27/01/17
FeS2 COD 9013067 Pnnm (58) 6 40 3 0.8098 1.147 0.000 (0;000) 27/01/17
ReN2 ICSD 187448 Pm (6) 6 50 3 0.0 0.009 0.644 (1;000) 06/10/16
ZrGa2 ICSD 104041 Cmmm (65) 6 76 3 0.0 0.016 0.470 (1;110) 06/10/16
Ba2CuClO2 COD 2002176 R-3m (166) 6 50 2 2.3733 2.373 0.000 (0;000) 05/01/17
CrAs2 ICSD 43898 C2/m (12) 6 48 3 0.0 0.022 0.319 (0;000) 05/01/17
Ba2H3Cl ICSD 416893 P-3m1 (164) 6 30 1 2.1081 2.626 0.000 (0;000) 05/01/17
NbSe2 ICSD 16304 P6_3/mmc (194) 6 50 2 0.0 0.000 0.896 (0;100) 06/10/16
TeRhCl ICSD 405714 Cm (8) 6 60 2 0.7234 0.728 0.000 (0;000) 06/10/16
FeSb2 COD 9012580 Pnnm (58) 6 36 3 0.0 0.188 0.031 (0;000) 27/01/17
FeSb2 ICSD 186639 I4/mcm (140) 6 36 3 0.0 0.009 0.620 (1;111) 27/01/17
Ni2Ge ICSD 637346 P6_3/mmc (194) 6 48 3 0.0 0.005 0.733 (0;000) 06/10/16
GeO2 ICSD 158598 Pmnn (58) 6 32 3 3.2329 3.286 0.000 (0;000) 06/10/16
MnGaGe ICSD 634255 P4/nmm (129) 6 64 3 0.0 0.012 0.201 (0;001) 27/01/17
FeSn2 COD 1524518 I4/mcm (140) 6 72 3 0.0 0.010 0.417 (0;000) 27/01/17
ReNCl4 ICSD 419181 I4 (79) 6 48 2 1.0756 1.276 0.000 (0;000) 06/10/16
ReNCl4 ICSD 10126 P1 (1) 6 48 1 1.098 1.204 0.000 (0;000) 06/10/16
MoAs2 ICSD 16820 C2 (5) 6 48 3 0.0 0.044 0.308 (0;000) 06/10/16
CoSbS ICSD 40044 Pmn2_1 (31) 6 40 3 0.0 0.367 0.147 (0;000) 06/10/16
Ba2PdO3 COD 1000071 Immm (71) 6 56 1 0.0 0.488 0.043 (0;000) 05/01/17
NiP2 ICSD 27160 C2/c (15) 6 40 3 0.5384 0.618 0.000 (0;000) 06/10/16
GaCuI4 ICSD 400817 I-4 (82) 6 52 3 1.6021 1.602 0.000 (0;000) 06/10/16
BaCuBi COD 1527798 P6_3/mmc (194) 6 72 2 0.0 0.003 0.179 (1;000) 05/01/17
HfCuSn ICSD 190121 P6_3mc (186) 6 74 3 0.0 0.000 0.548 (1;001) 05/12/16
BaBrF COD 9011174 P4/nmm (129) 6 48 1 4.6989 4.699 0.000 (0;000) 05/01/17
BaHBr COD 9009158 P4/nmm (129) 6 36 1 3.4293 3.429 0.000 (0;000) 05/01/17
BaCd2 ICSD 58643 Imma (74) 6 68 3 0.0 0.042 0.486 (1;111) 05/01/17