≤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
Nb2CS2 COD 1532142 P-3m1 (164) ✔ 5 42 2 0.0 0.034 0.307 (1;001) ✗ 27/01/17
Nb2CS2 COD 1532143 R-3m (166) ✔ 5 42 2 0.0 0.017 0.340 (0;111) ✗ 27/01/17
ZrTiF6 COD 1532187 Fm-3m (225) ✔ 8 58 3 0.0 0.000 0.676 (0;000) ✗ 27/01/17
Ca2SiIr2 COD 1532211 C2/c (15) ✔ 10 116 3 0.0 0.096 0.412 (0;110) ✗ 02/02/17
Cs2PdCl4 COD 1532214 Cmcm (63) ✔ 14 128 1 1.6548 1.655 0.000 (0;000) ✗ 02/02/17
Cs2PdCl4 COD 1532216 P4/mmm (123) ✔ 7 64 1 1.6208 1.621 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
RbMnBr3 COD 1532234 P6_3/mmc (194) ✔ 10 90 1 0.0 0.000 0.748 (0;000) ✗ 02/02/17
CsBF4 COD 1532247 Pnma (62) ✔ 24 160 1 7.8917 7.931 0.000 (0;000) ✗ 04/08/17
Rb3CoO2 COD 1532295 Pnma (62) ✔ 24 224 1 0.0 0.003 0.119 (1;000) ✗ 04/08/17
SrCu2O3 COD 1532418 Pmmn (59) ✔ 12 100 3 0.0 0.002 0.729 (0;000) ✗ 27/01/17
Li4SiO4 COD 1532523 P-1 (2) ✔ 18 80 1 4.9579 5.193 0.000 (0;000) ✗ 27/01/17
Hf(MoO4)2 COD 1532569 C2/c (15) ✔ 22 176 3 2.8462 2.846 0.000 (0;000) ✗ 07/08/17
Li3AlH6 COD 1532615 R-3 (148) ✔ 20 36 2 3.6166 3.945 0.000 (0;000) ✗ 05/01/17
KAlH4 COD 1532616 Pnma (62) ✔ 24 64 1 5.0402 5.300 0.000 (0;000) ✗ 04/08/17
KH4F5 COD 1532621 I4_1/a (88) ✔ 20 96 1 5.6134 5.613 0.000 (0;000) ✗ 02/02/17
TiSnSb COD 1532679 Fddd (70) ✔ 12 124 3 0.0 0.001 0.667 (1;111) ✗ 02/02/17
NbBiO4 COD 1532718 Pnna (52) ✔ 24 208 3 2.8013 2.921 0.000 (0;000) ✗ 04/08/17
TaBiO4 COD 1532721 Pnna (52) ✔ 24 208 3 2.9069 2.907 0.000 (0;000) ✗ 04/08/17
Ba(AlGe)2 COD 1532737 Pnma (62) ✔ 20 96 3 0.0 0.004 0.120 (0;000) ✗ 30/01/17
K3Zn2F7 COD 1532738 I4/mmm (139) ✔ 12 100 2 4.0551 5.518 0.000 (0;000) ✗ 22/03/17
Ba(AlGe)2 COD 1532740 I4/mmm (139) ✔ 5 24 2 0.0 0.028 0.264 (0;000) ✗ 05/01/17
BaZrO3 COD 1532743 Pm-3m (221) ✔ 5 32 3 2.7993 2.799 0.000 (0;000) ✗ 05/01/17
CaZrO3 COD 1532747 Pnma (62) ✔ 20 128 3 3.4975 3.498 0.000 (0;000) ✗ 02/02/17
LiHS COD 1532751 P4_2/mbc (135) ✔ 24 80 1 3.5998 3.600 0.000 (0;000) ✗ 04/08/17
LiHS COD 1532755 Pmc2_1 (26) ✗ 12 40 1 3.5171 3.517 0.000 (0;000) ✗ 15/02/17
MoPRu COD 1532784 Pnma (62) ✔ 12 140 3 0.0 0.000 0.713 (0;011) ✗ 27/01/17
Y2Pd2Pb COD 1532869 P4/mbm (127) ✔ 10 144 3 0.0 0.006 0.632 (0;000) ✗ 02/02/17
Na2RuO3 COD 1532912 C2/c (15) ✔ 24 208 3 0.0 0.023 0.366 (0;000) ✗ 04/08/17
YAlSi COD 1533018 Cmcm (63) ✔ 6 36 3 0.0 0.015 0.313 (0;110) ✗ 05/01/17
CaTiF6 COD 1533036 R-3m (166) ✔ 8 64 3 3.9477 3.948 0.000 (0;000) ✗ 27/01/17
Ni2SbTe2 COD 1533053 P6_3/mmc (194) ✔ 10 74 2 0.0 0.000 0.889 (0;000) ✗ 02/02/17
YAlO3 COD 1533069 Pnma (62) ✔ 20 128 3 5.6486 5.665 0.000 (0;000) ✗ 30/01/17
CsGaSe3 COD 1533091 P2_1/c (14) ✔ 20 160 1 1.9338 2.031 0.000 (0;000) ✗ 02/02/17
SbClF8 COD 1533112 P-1 (2) ✔ 20 136 1 3.0697 3.115 0.000 (0;000) ✗ 02/02/17
SbAsF8 COD 1533113 P2_1/m (11) ✔ 20 132 1 4.5459 4.676 0.000 (0;000) ✗ 30/01/17
MnSeO3 COD 1533149 Pnma (62) ✔ 20 156 3 0.0 0.001 0.434 (0;110) ✗ 02/02/17
Rb2CrCl4 COD 1533153 I4/mmm (139) ✔ 7 60 1 0.0 0.008 0.180 (1;111) ✗ 02/02/17
Ba3CrS5 COD 1533192 P6_3cm (185) ✗ 18 148 1 0.0 0.000 0.838 ? ✗ 21/03/17
Ba3(CrS3)2 COD 1533193 R-3c (167) ✔ 22 188 1 0.0 0.005 0.126 (1;000) ✗ 07/08/17
Li4ZrGe2 COD 1533277 R-3m (166) ✔ 7 24 1 0.0 0.008 0.572 (1;000) ✗ 27/01/17
Ca3Mn2O7 COD 1533328 I4/mmm (139) ✔ 12 102 3 0.0 0.007 0.968 (0;000) ✗ 21/03/17
TeI COD 2000148 P-1 (2) ✔ 16 104 1 0.7663 0.767 0.000 (0;000) ✗ 02/02/17
CN COD 2000225 C2/c (15) ✔ 24 108 1 0.0 0.002 0.461 (0;110) ✗ 04/08/17
BiMoO2 COD 2000338 I4_1/a (88) ✔ 16 164 3 0.0 0.023 0.324 (1;111) ✗ 21/03/17
HIO3 COD 2000582 P2_12_12_1 (19) ✗ 20 104 3 3.1754 3.229 0.000 (0;000) ✗ 29/03/17
SrBiO3 COD 2000656 Cmcm (63) ✔ 10 86 1 0.0 0.000 0.951 (1;110) ✗ 05/01/17
LiInF4 COD 2000863 Pbcn (60) ✔ 24 176 2 4.4823 4.482 0.000 (0;000) ✗ 04/08/17
BaSi2CuO6 COD 2001087 I4/mmm (139) ✔ 20 130 2 0.0 0.003 0.025 (0;111) ✗ 02/02/17
C3S8 COD 2001128 P-1 (2) ✔ 22 120 1 1.5344 1.628 0.000 (0;000) ✗ 04/08/17
LiYF2 COD 2001129 I4_1/a (88) ✔ 16 112 3 0.0 0.010 0.659 (1;111) ✗ 22/03/17
ZrSnS3 COD 2001131 Pnma (62) ✔ 20 144 2 0.8146 0.816 0.000 (0;000) ✗ 02/02/17
P2CS2(OF)2 COD 2001345 P2 (3) ✗ 18 104 1 3.9644 4.085 0.000 (0;000) ✗ 22/03/17
Ba4Na(SbO4)3 COD 2001366 Im-3m (229) ✔ 20 136 3 1.8829 1.962 0.000 (0;000) ✗ 02/02/17
KInTe2 COD 2001367 I4/mcm (140) ✔ 8 68 1 0.9234 1.267 0.000 (0;000) ✗ 02/02/17
K2ZnBr4 COD 2001701 P2_1/m (11) ✔ 14 116 1 3.6748 3.675 0.000 (0;000) ✗ 02/02/17
BaO2 COD 2001842 I4/mmm (139) ✔ 3 22 1 2.1926 2.193 0.000 (0;000) ✗ 05/01/17
K2ReO2 COD 2001934 I4_1/a (88) ✔ 20 180 3 0.0 0.017 0.165 (1;111) ✗ 02/02/17
TaFeTe3 COD 2002027 P2_1 (4) ✗ 10 78 3 0.0 0.001 0.821 ? ✗ 22/03/17
BaV2(NiO4)2 COD 2002114 R-3 (148) ✔ 13 104 2 0.0154 0.027 0.000 (0;111) ✗ 05/01/17
Sr3Cr2O8 COD 2002131 R-3m (166) ✔ 13 106 1 0.0 0.000 0.246 (1;111) ✗ 22/03/17
RePCl9 COD 2002164 P-1 (2) ✔ 22 166 1 0.0 0.030 0.028 (0;000) ✗ 07/08/17
MoPCl9 COD 2002166 P-1 (2) ✔ 22 164 1 0.0 0.003 0.367 (0;010) ✗ 04/08/17
Ba2CuClO2 COD 2002176 R-3m (166) ✔ 6 50 2 2.3733 2.373 0.000 (0;000) ✗ 05/01/17
PdPbO2 COD 2002191 Imma (74) ✔ 8 88 3 0.0 0.441 0.182 (0;000) ✗ 27/01/17
MgCu2O3 COD 2002199 Pmmn (59) ✔ 12 100 3 0.0 0.005 0.977 (0;000) ✗ 27/01/17
Ba(CuO)2 COD 2002215 I4_1/amd (141) ✔ 10 88 3 1.3364 1.336 0.000 (0;000) ✗ 05/01/17
Bi2PdO4 COD 2002219 I4cm (108) ✗ 14 144 3 0.0 0.002 0.167 (0;000) ✔ 13/04/17
BaMn2O3 COD 2002227 Immm (71) ✔ 6 58 3 0.0 0.018 0.450 (0;000) ✗ 05/01/17
SrGa4O7 COD 2002229 C2/c (15) ✔ 24 208 3 2.8686 2.869 0.000 (0;000) ✗ 04/08/17
CaGa4O7 COD 2002230 C2/c (15) ✔ 24 208 3 3.0163 3.016 0.000 (0;000) ✗ 04/08/17
Cu(BiO2)2 COD 2002233 I4 (79) ✗ 14 130 3 0.0 0.015 0.180 (0;000) ✔ 11/04/17
NbFeO4 COD 2002235 P2/c (13) ✔ 12 90 3 0.0 0.000 0.459 (0;010) ✗ 27/01/17
NbFeO4 COD 2002236 C2/m (12) ✔ 12 90 3 0.0 0.016 0.836 (0;000) ✗ 27/01/17
Sr2Fe2O5 COD 2002240 Ima2 (46) ✗ 18 132 3 0.0 0.001 0.480 ? ✗ 22/03/17
CaCu2O3 COD 2002243 Pmmn (59) ✔ 12 100 3 0.0 0.009 0.954 (0;000) ✗ 27/01/17
Ba2MnO3 COD 2002251 Cc (9) ✗ 24 212 3 0.0 0.000 0.113 ? ✗ 04/08/17
NbCoO4 COD 2002264 C2/m (12) ✔ 12 108 3 0.1218 0.163 0.000 (0;000) ✗ 27/01/17
Sr2In2O5 COD 2002271 Ima2 (46) ✗ 18 152 3 1.2457 1.246 0.000 (0;000) ✗ 29/03/17
SrNiO2 COD 2002309 Cmcm (63) ✔ 8 64 1 0.0 0.026 0.485 (0;000) ✗ 27/01/17
Ti2FeO5 COD 2002318 Cmcm (63) ✔ 16 124 3 0.0 0.006 0.214 (1;000) ✗ 22/03/17
Al4Cu2O7 COD 2002328 F-43m (216) ✗ 13 76 3 0.0 0.000 0.247 (1;000) ✔ 26/04/17
Sr3Fe2Cl2O5 COD 2002334 I4/mmm (139) ✔ 12 90 1 0.0 0.004 0.683 (0;000) ✗ 22/03/17
Ta2NiO6 COD 2002356 P4_2/mnm (136) ✔ 18 144 3 0.0 0.005 0.556 (0;000) ✗ 02/02/17
Ti2CrO5 COD 2002414 C2/c (15) ✔ 16 136 3 0.0 0.004 0.425 (0;000) ✗ 22/03/17
Ba3In2O6 COD 2002418 I4/mmm (139) ✔ 11 92 2 0.9533 1.427 0.000 (0;000) ✗ 21/03/17
Sr2CuBrO2 COD 2002429 R-3m (166) ✔ 6 50 1 2.4164 2.627 0.000 (0;000) ✗ 27/01/17
MgTa2O6 COD 2002433 P4_2/mnm (136) ✔ 18 144 3 2.9855 3.037 0.000 (0;000) ✗ 02/02/17
Sr3Ru2O7 COD 2002466 I4/mmm (139) ✔ 12 104 2 0.0 0.001 0.964 (0;000) ✗ 29/03/17
Ba2CuBrO2 COD 2002478 R-3m (166) ✔ 6 50 2 2.3456 2.346 0.000 (0;000) ✗ 05/01/17
Ba2YBiO6 COD 2002487 Fm-3m (225) ✔ 10 82 3 2.1129 2.178 0.000 (0;000) ✗ 05/01/17
BaHgO2 COD 2002491 P6_322 (182) ✗ 24 204 1 2.1697 2.247 0.000 (0;000) ✗ 04/08/17
TaAlO4 COD 2002498 C2/m (12) ✔ 12 80 3 4.1642 4.519 0.000 (0;000) ✗ 05/01/17
CoCu2O3 COD 2002500 Pmmn (59) ✔ 12 114 3 0.0 0.000 0.977 (1;000) ✗ 27/01/17
BaY2NiO5 COD 2002505 Immm (71) ✔ 9 72 3 0.0 0.009 0.438 (0;000) ✗ 05/01/17
Ba3In2Cl2O5 COD 2002522 I4/mmm (139) ✔ 12 100 2 1.6797 2.375 0.000 (0;000) ✗ 02/02/17
Ca2PbO4 COD 2002530 Pbam (55) ✔ 14 116 1 1.7129 1.926 0.000 (0;000) ✗ 27/01/17
Ba2ZnO3 COD 2002534 C2/c (15) ✔ 24 200 2 2.883 2.885 0.000 (0;000) ✗ 04/08/17
Ba3In2Br2O5 COD 2002540 I4/mmm (139) ✔ 12 100 2 1.5364 2.122 0.000 (0;000) ✗ 21/03/17
Na(CuO)2 COD 2002542 Pnma (62) ✔ 20 172 3 0.0 0.000 0.797 (1;011) ✗ 02/02/17