≤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
NiH2(CN2)2 ICSD 172908 Pnnm (58) 18 80 3 0.0 0.007 0.305 (0;000) 27/01/17
Al2O3 ICSD 173014 P1 (1) 10 48 3 0.0 0.285 1.000 (0;000) 06/10/16
BBr3 ICSD 173374 P2_1/m (11) 8 48 1 3.5823 3.889 0.000 (0;000) 06/10/16
BI3 ICSD 173375 P2_1/m (11) 8 48 1 2.4262 2.516 0.000 (0;000) 06/10/16
Sr2CoReO6 ICSD 173491 P2_1/c (14) 20 176 3 0.0 0.035 0.475 (0;000) 02/02/17
Sr2ZnReO6 ICSD 173492 P2_1/c (14) 20 166 3 0.0 0.000 0.780 (0;101) 02/02/17
Zr2Al4C5 ICSD 173676 R3m (160) 11 40 3 0.0 0.014 0.496 (0;000) 06/10/16
Zr3(Al2C3)2 ICSD 173677 R3m (160) 13 48 3 0.0 0.010 0.526 ? 06/10/16
SiC(ClF)3 ICSD 173735 C2/m (12) 16 100 1 6.2495 6.314 0.000 (0;000) 02/02/17
Bi(BO2)3 ICSD 173745 C2 (5) 10 50 3 3.5492 3.755 0.000 (0;000) 06/10/16
Bi(BO2)3 ICSD 173746 P1 (1) 10 50 3 2.2969 2.382 0.000 (0;000) 06/10/16
BaZr(PO4)2 ICSD 173842 P-3m1 (164) 12 72 2 3.7473 3.815 0.000 (0;000) 05/01/17
Ge ICSD 173890 Ia3 (206) 8 32 3 0.0 0.000 0.231 (1;111) 27/01/17
BaO ICSD 173921 P6_3/mmc (194) 4 32 1 2.2677 2.285 0.000 (0;000) 05/01/17
Cs ICSD 173930 Pbcm (57) 4 36 3 0.0 0.004 0.757 (1;100) 27/01/17
KMnCl ICSD 173938 Imma (74) 6 62 1 0.0 0.001 0.755 (1;101) 02/02/17
KMnCl3 ICSD 173939 Pnma (62) 20 180 3 0.0 0.002 0.327 (0;110) 02/02/17
KCN ICSD 173942 Cc (9) 6 36 1 5.131 5.273 0.000 (0;000) 06/10/16
Sb7Mo3 ICSD 173972 Im-3m (229) 20 154 3 0.0 0.000 0.772 (0;111) 02/02/17
LiCO2 ICSD 173993 P2_1/c (14) 16 76 1 3.6516 3.677 0.000 (0;000) 27/01/17
C2SeN2 ICSD 173995 Cmce (64) 20 96 1 0.0 0.137 0.007 (0;000) 02/02/17
Hg ICSD 174005 R-3m (166) 1 12 3 0.0 0.032 0.397 (1;000) 27/01/17
NaNO2 ICSD 174026 Im2m (44) 4 26 1 2.5123 2.696 0.000 (0;000) 06/10/16
Ti4O5 ICSD 174033 I4/m (87) 9 78 3 0.0 0.003 0.821 (1;111) 06/10/16
NaNO2 ICSD 174034 Imm2 (44) 4 26 1 2.5796 2.742 0.000 (0;000) 06/10/16
CsFeBr3 ICSD 174041 P6_3/mmc (194) 10 76 1 0.0 0.042 0.009 (0;000) 02/02/17
Fe(RhS2)2 ICSD 174045 Fd-3m (227) 14 132 3 0.0 0.000 0.831 (0;000) 02/02/17
Y3SbO7 ICSD 174071 Cmcm (63) 22 160 3 2.9866 3.270 0.000 (0;000) 07/08/17
NaSi ICSD 174082 C2/c (15) 16 104 1 1.0045 1.393 0.000 (0;000) 02/02/17
Ag3SI ICSD 174095 R3 (146) 5 46 3 0.4293 0.829 0.000 (0;000) 06/10/16
K2CuF4 ICSD 174116 Cmce (64) 14 114 2 0.0 0.000 0.932 (0;000) 02/02/17
Al2CdSe4 ICSD 174192 I-4 (82) 7 42 3 2.0835 2.084 0.000 (0;000) 06/10/16
Si3MoPt2 ICSD 174199 Pm2_1b (26) 12 92 3 0.0 0.007 0.557 ? 06/10/16
SrMoO3 ICSD 174206 Pm-3m (221) 5 42 3 0.0 0.000 0.772 (0;000) 27/01/17
SrMoO3 ICSD 174207 Pm-3m (221) 5 42 3 0.0 0.000 0.772 (0;000) 27/01/17
KTi2F7 ICSD 174209 Cmmm (65) 10 82 3 0.0 0.014 0.924 (0;000) 04/08/17
Sn4Rh ICSD 174219 I4_1/acd (142) 20 292 3 0.0 0.001 0.550 (1;111) 29/03/17
P2Ir ICSD 174222 P2_1/c (14) 12 108 3 0.7499 1.526 0.000 (0;000) 27/01/17
BaGe3Pd ICSD 174261 I4mm (107) 5 32 3 0.0 0.018 0.403 (1;111) 07/10/16
BaGe3Pt ICSD 174262 I4mm (107) 5 32 3 0.0 0.014 0.403 (1;011) 07/10/16
Ba(CdGe)2 ICSD 174263 I4/mmm (139) 5 42 3 0.0 0.038 0.327 (1;111) 05/01/17
BaSi3Pd ICSD 174266 I4mm (107) 5 32 3 0.0 0.017 0.443 (0;001) 07/10/16
BaSi3Pt ICSD 174267 I4mm (107) 5 32 3 0.0 0.002 0.442 (0;001) 07/10/16
SrSi3Ni ICSD 174268 I4mm (107) 5 32 3 0.0 0.039 0.440 (0;111) 07/10/16
Ba(ZnSi)2 ICSD 174269 I4/mmm (139) 5 42 3 0.0 0.005 0.274 (1;000) 05/01/17
Ba2BiIrO6 ICSD 174289 Fm-3m (225) 10 88 3 0.0 0.327 0.036 (0;000) 05/01/17
KZnB(H2Cl)2 ICSD 174294 P2_1/m (11) 18 84 1 4.9323 4.932 0.000 (0;000) 02/02/17
Sn3O4 ICSD 174299 P2/c (13) 14 132 3 0.0 0.032 0.525 (0;100) 02/02/17
K6Fe2O5 ICSD 174312 Cm (8) 13 100 1 0.0152 0.035 0.000 (0;100) 05/12/16
Cs4Fe2O5 ICSD 174317 C2/c (15) 22 164 3 0.0 0.003 0.205 (0;000) 07/08/17
K2Y4Cu4Se9 ICSD 174375 C2/m (12) 19 160 3 0.6382 0.850 0.000 (0;000) 02/02/17
CrBiO3 ICSD 174403 Pnma (62) 20 188 3 0.0 0.001 0.448 (0;110) 02/02/17
CrBiO3 ICSD 174404 C2/c (15) 20 188 3 0.0 0.003 0.244 (1;000) 02/02/17
CuAgF3 ICSD 174407 P-1 (2) 20 172 3 0.0 0.009 0.589 (1;011) 30/01/17
LiCr(GeO3)2 ICSD 174432 C2/c (15) 20 122 3 0.0 0.000 0.425 (1;011) 02/02/17
Ga7Pd3 ICSD 174527 Im-3m (229) 20 290 3 0.0 0.000 0.807 (1;000) 02/02/17
Sr3Fe2(ClO2)2 ICSD 174532 I4/mmm (139) 11 84 1 0.0 0.003 0.804 (0;000) 22/03/17
YVO4 ICSD 174550 I4_1/a (88) 12 96 3 3.5058 3.536 0.000 (0;000) 27/01/17
Ba(Ge3Pt)4 ICSD 174551 Im3 (204) 17 98 3 0.0 0.028 0.522 (1;000) 02/02/17
TiNiSn ICSD 174568 F-43m (216) 3 36 3 0.4583 1.126 0.000 (0;000) 15/02/17
PbSe2 ICSD 174577 I4/mcm (140) 6 52 3 0.0 0.110 0.122 (0;000) 27/01/17
CdTcO3 ICSD 180009 Pnma (62) 20 180 3 0.0 0.001 0.355 (0;110) 02/02/17
LiTi2O4 ICSD 180011 C2/m (12) 14 102 3 0.0 0.003 0.478 (1;001) 29/03/17
Cs3ZnBr5 ICSD 180053 I4/mcm (140) 18 148 1 3.737 3.737 0.000 (0;000) 02/02/17
Li2MgIr ICSD 180119 P-43m (215) 16 132 3 0.0 0.000 0.843 ? 29/03/17
FeBiO3 ICSD 180128 R3c (161) 10 62 3 0.0 0.000 0.500 ? 06/10/16
NaFe(GeO3)2 ICSD 180305 C2/c (15) 20 122 3 0.0 0.000 0.291 (1;101) 02/02/17
YH3 ICSD 180317 Cmcm (63) 8 28 3 0.0 0.036 0.026 (1;000) 06/10/16
MgCO3 ICSD 180346 R-3c (167) 10 64 3 5.0198 5.730 0.000 (0;000) 06/10/16
MgCO3 ICSD 180347 R-3c (167) 10 64 3 5.1369 5.732 0.000 (0;000) 06/10/16
CaCO3 ICSD 180348 R-3c (167) 10 64 2 5.0647 5.184 0.000 (0;000) 06/10/16
CaCO3 ICSD 180349 R-3c (167) 10 64 2 5.1604 5.214 0.000 (0;000) 06/10/16
Mg2Al4Zn3 ICSD 180365 P6_3/mmc (194) 18 136 3 0.0 0.018 0.743 (1;000) 30/01/17
Re2C ICSD 180376 P6_3/mmc (194) 6 68 3 0.0 0.017 0.656 (1;000) 27/01/17
BaO2 ICSD 180398 Cmmm (65) 3 22 2 0.6441 1.164 0.000 (0;000) 05/01/17
CdSnO3 ICSD 180400 R-3 (148) 10 88 3 1.1762 1.263 0.000 (0;000) 27/01/17
Ti3GeC2 ICSD 180428 P6_3/mmc (194) 12 96 3 0.0 0.015 0.413 (1;000) 27/01/17
FeBiO3 ICSD 180495 R3c (161) 10 62 3 0.0 0.001 0.519 ? 06/10/16
FeBiO3 ICSD 180496 R3c (161) 10 62 3 0.0 0.000 0.519 ? 06/10/16
FeBiO3 ICSD 180497 R3c (161) 10 62 3 0.0 0.000 0.519 ? 06/10/16
FeBiO3 ICSD 180498 R3c (161) 10 62 3 0.0 0.000 0.519 ? 06/10/16
FeBiO3 ICSD 180499 R3c (161) 10 62 3 0.0 0.001 0.519 ? 06/10/16
FeBiO3 ICSD 180500 R3c (161) 10 62 3 0.0 0.000 0.519 ? 06/10/16
FeBiO3 ICSD 180501 R3c (161) 10 62 3 0.0 0.000 0.519 ? 06/10/16
FeBiO3 ICSD 180502 R3c (161) 10 62 3 0.0 0.000 0.519 ? 06/10/16
FeBiO3 ICSD 180503 R3c (161) 10 62 3 0.0 0.000 0.518 ? 06/10/16
FeBiO3 ICSD 180504 R3c (161) 10 62 3 0.0 0.000 0.520 ? 06/10/16
FeBiO3 ICSD 180505 R3c (161) 10 62 3 0.0 0.000 0.527 ? 06/10/16
Sr2ScFeAsO3 ICSD 180528 P4/nmm (129) 16 124 1 0.0 0.016 0.426 (0;000) 30/01/17
Sr2CrFeAsO3 ICSD 180529 P4/nmm (129) 16 130 1 0.0 0.000 0.894 (1;001) 30/01/17
K2O2 ICSD 180559 Ccme (64) 8 60 1 2.5679 2.644 0.000 (0;000) 06/10/16
NaO2 ICSD 180562 Pmnn (58) 6 42 1 0.0 0.000 0.985 (0;110) 06/10/16
SiAg2S3 ICSD 180764 P2_1/c (14) 24 176 3 1.3432 1.508 0.000 (0;000) 04/08/17
NiBi3 ICSD 180771 Pmnb (62) 16 100 3 0.0 0.003 0.726 (0;011) 06/10/16
ClO2 ICSD 180778 Pbca (61) 24 152 1 0.4052 0.405 0.000 (0;000) 04/08/17
CoAgO2 ICSD 180889 P6_3/mmc (194) 8 80 3 0.0 0.002 0.391 (1;000) 05/01/17
InP ICSD 180911 P6_3mc (186) 4 36 3 0.5486 0.549 0.000 (0;000) 06/10/16
CdSe ICSD 180931 F-43m (216) 2 18 3 0.3656 0.366 0.000 (0;000) 06/10/16
Ba2Cd(BO3)2 ICSD 180954 C2/m (12) 11 74 2 3.3341 3.334 0.000 (0;000) 05/01/17
CaSi3Pt ICSD 180963 I4mm (107) 5 32 3 0.0 0.023 0.403 (0;111) 07/10/16