≤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
LiBi(PdO2)2 COD 1000075 P4/nmm (129) ✔ 16 156 3 0.3386 0.881 0.000 (0;000) ✗ 02/02/17
LiSbO3 COD 1000141 Pnna (52) ✔ 20 104 3 2.5446 2.545 0.000 (0;000) ✗ 02/02/17
MnCrF5 COD 1000158 C2/c (15) ✔ 14 128 3 0.0 0.024 0.250 (0;110) ✗ 27/01/17
Cs2NaAl3F12 COD 1000164 R-3m (166) ✔ 18 120 3 0.4217 0.565 0.000 (0;000) ✗ 30/01/17
Cs2LiAl3F12 COD 1000165 R-3m (166) ✔ 18 114 1 6.8333 6.936 0.000 (0;000) ✗ 30/01/17
Li2TiF6 COD 1000167 P4_2/mnm (136) ✔ 18 120 1 4.0121 4.012 0.000 (0;000) ✗ 27/01/17
CrAg(PS3)2 COD 1000192 P2/c (13) ✔ 20 142 2 0.0 0.000 0.260 (0;000) ✗ 16/03/17
KAlF4 COD 1000207 P4/mbm (127) ✔ 12 80 2 7.2718 7.309 0.000 (0;000) ✗ 05/01/17
KAlF4 COD 1000208 P2_1/m (11) ✔ 24 160 1 7.1678 7.174 0.000 (0;000) ✗ 04/08/17
BaFeCuF7 COD 1000216 Cc (9) ✗ 20 156 3 0.0 0.009 0.016 (0;000) ✔ 21/03/17
AlTlF4 COD 1000222 P4/mmm (123) ✔ 6 44 2 4.0014 4.158 0.000 (0;000) ✗ 05/01/17
FeF3 COD 1000228 Fd-3m (227) ✔ 16 116 3 0.0 0.000 0.705 (0;000) ✗ 02/02/17
InAg(PS3)2 COD 1000229 P-31c (163) ✔ 20 140 2 1.1317 1.352 0.000 (0;000) ✗ 30/01/17
NaCu3F7 COD 1000232 C2/c (15) ✔ 22 182 3 0.0 0.000 0.650 (1;011) ✗ 07/08/17
AlF3 COD 1000238 Cmcm (63) ✔ 24 144 3 7.8409 7.841 0.000 (0;000) ✗ 04/08/17
LiFe2F6 COD 1000239 P4_2nm (102) ✗ 18 122 3 0.0 0.000 0.774 ? ✗ 22/03/17
BaY2PdO5 COD 1000242 P4/mbm (127) ✔ 18 160 3 2.2474 2.377 0.000 (0;000) ✗ 02/02/17
LiCoF4 COD 1000261 P2_1/c (14) ✔ 12 96 2 0.0757 0.121 0.000 (0;000) ✗ 27/01/17
CaAlF5 COD 1000300 C2/c (15) ✔ 14 96 1 7.4033 7.403 0.000 (0;000) ✗ 05/01/17
Ba2TiOF6 COD 1000341 Cc (9) ✗ 20 160 1 4.1131 4.113 0.000 (0;000) ✗ 21/03/17
MnAlF5 COD 1000348 Cmcm (63) ✔ 14 106 3 0.0 0.000 0.396 (0;000) ✗ 05/01/17
AlFeF5 COD 1000363 Immm (71) ✔ 7 46 3 0.0 0.098 0.084 (0;000) ✗ 05/01/17
KCuCO3F COD 1000372 Pmc2_1 (26) ✗ 14 98 3 0.0 0.000 0.871 ? ✗ 15/02/17
NaV(OF)2 COD 1000373 P2_1 (4) ✗ 12 96 1 2.0236 2.570 0.000 (0;000) ✗ 15/02/17
CaTl2O4 COD 1000379 Cmcm (63) ✔ 14 120 3 0.0168 0.077 0.000 (0;000) ✗ 27/01/17
AlTlF4 COD 1000407 I4/mcm (140) ✔ 12 88 2 4.0057 4.006 0.000 (0;000) ✗ 05/01/17
AlTlF4 COD 1000410 C2/c (15) ✔ 12 88 2 0.0 0.083 0.654 (1;110) ✗ 05/01/17
CsPd2F5 COD 1000425 Imma (74) ✔ 16 160 3 0.0 0.002 0.382 (0;000) ✗ 02/02/17
RbAlF4 COD 1000453 P4/mmm (123) ✔ 6 40 2 7.1638 7.596 0.000 (0;000) ✗ 05/01/17
RbAlF4 COD 1000454 P4/mbm (127) ✔ 12 80 2 7.2538 7.349 0.000 (0;000) ✗ 05/01/17
RbAlF4 COD 1000457 Pmmn (59) ✔ 24 160 1 7.3074 7.339 0.000 (0;000) ✗ 04/08/17
AlF3 COD 1000467 R-3c (167) ✔ 8 48 3 8.0575 8.058 0.000 (0;000) ✗ 05/01/17
VF3 COD 1000468 R-3c (167) ✔ 8 68 3 0.0 0.014 0.628 (0;000) ✗ 27/01/17
K2AlF5 COD 1000479 P4/mmm (123) ✔ 8 56 1 6.503 6.546 0.000 (0;000) ✗ 05/01/17
Cs2NaAl3F12 COD 1000492 R-3m (166) ✔ 18 120 1 7.3545 7.371 0.000 (0;000) ✗ 30/01/17
K3Nb3(BO6)2 COD 1001007 P31m (157) ✗ 20 144 3 2.121 2.252 0.000 (0;000) ✗ 21/03/17
Ta2CrO6 COD 1001053 Pmna (53) ✔ 18 152 2 0.0 0.010 0.756 (0;000) ✗ 02/02/17
Ta2CrO6 COD 1001091 P4_2/mnm (136) ✔ 18 152 3 0.0 0.003 0.221 (0;000) ✗ 22/03/17
CuHgSeCl COD 1001109 Pbam (55) ✔ 16 144 3 0.868 0.874 0.000 (0;000) ✗ 02/02/17
NaClO3 COD 1001127 P2_1/c (14) ✔ 20 136 1 4.8842 4.976 0.000 (0;000) ✗ 02/02/17
Fe3Ge COD 1001144 P6_3/mmc (194) ✔ 8 56 3 0.0 0.000 0.549 (1;000) ✗ 27/01/17
Ta2VO6 COD 1001151 P4_2/mnm (136) ✔ 18 150 3 0.0 0.000 0.871 (0;000) ✗ 27/01/17
Cd2AsCl2 COD 1001161 P2_1/c (14) ✔ 20 172 3 1.2332 1.371 0.000 (0;000) ✗ 21/03/17
In6WO12 COD 1001180 R-3 (148) ✔ 19 164 3 2.2144 2.226 0.000 (0;000) ✗ 02/02/17
KNb3O8 COD 1001208 Cmcm (63) ✔ 24 192 1 2.7746 2.840 0.000 (0;000) ✗ 04/08/17
Si3N4 COD 1001249 P6_3/m (176) ✔ 14 64 3 3.8214 4.349 0.000 (0;000) ✗ 27/01/17
Ba2Y(CuO2)3 COD 1001421 P4/mmm (123) ✔ 12 100 3 0.0 0.013 0.961 (1;000) ✗ 05/01/17
NaVPO5 COD 1001468 P2_1 (4) ✗ 16 114 2 0.0 0.001 0.648 ? ✗ 29/03/17
Li2ZrTeO6 COD 1001503 R3 (146) ✗ 10 52 3 1.7277 2.063 0.000 (0;000) ✗ 15/02/17
Cd3PCl3 COD 1001626 P-3 (147) ✔ 14 124 3 2.0234 2.170 0.000 (0;000) ✗ 02/02/17
BaMo(PO4)2 COD 1001653 C2/m (12) ✔ 12 82 2 0.0 0.057 0.693 (0;000) ✗ 05/01/17
Al2Ge2O7 COD 1001676 C2/c (15) ✔ 22 112 3 3.942 3.942 0.000 (0;000) ✗ 04/08/17
Ga4GeO8 COD 1001682 C2/m (12) ✔ 13 104 3 2.4626 2.475 0.000 (0;000) ✗ 27/01/17
HfGeO4 COD 1001684 I4_1/a (88) ✔ 12 80 3 4.3629 4.433 0.000 (0;000) ✗ 27/01/17
NaNb3O8 COD 1001745 Pmmn (59) ✔ 24 192 1 3.1021 3.402 0.000 (0;000) ✗ 04/08/17
Ba3Tl2Cl2O5 COD 1001756 I4/mmm (139) ✔ 12 100 1 0.0 0.373 0.351 (0;000) ✗ 21/03/17
CdMoO4 COD 1001800 I4_1/a (88) ✔ 12 100 3 2.5086 2.554 0.000 (0;000) ✗ 27/01/17
MnSnO3 COD 1004021 R-3 (148) ✔ 10 94 3 0.0 0.002 0.322 (0;111) ✗ 27/01/17
CaSnO3 COD 1004022 R-3 (148) ✔ 10 84 1 3.4424 3.721 0.000 (0;000) ✗ 27/01/17
LiAlCl4 COD 1004036 P2_1/c (14) ✔ 24 136 1 5.7046 5.732 0.000 (0;000) ✗ 04/08/17
KAlCl4 COD 1004038 P2_1 (4) ✗ 24 160 1 5.4874 5.504 0.000 (0;000) ✗ 04/08/17
NaAlCl4 COD 1004043 P2_12_12_1 (19) ✗ 24 160 1 4.7141 4.714 0.000 (0;000) ✗ 04/08/17
CsAlCl4 COD 1004044 Pnma (62) ✔ 24 160 1 5.6761 5.681 0.000 (0;000) ✗ 04/08/17
WO3 COD 1004057 P6/mmm (191) ✔ 12 96 3 0.5769 1.475 0.000 (0;000) ✗ 27/01/17
KInBr4 COD 1004072 Pnna (52) ✔ 24 200 1 2.8711 2.871 0.000 (0;000) ✗ 04/08/17
Pt2PbO4 COD 1004132 P-1 (2) ✔ 14 116 3 2.687 0.084 1.000 (0;000) ✗ 29/03/17
Sr2Ru3O10 COD 1004145 C2/m (12) ✔ 15 128 2 0.0 0.021 0.453 (0;000) ✗ 27/01/17
CaNiN COD 1005001 P4_2/mmc (131) ✔ 6 50 3 0.0 0.001 0.963 (0;101) ✗ 27/01/17
Ca2ZnN2 COD 1005002 I4/mmm (139) ✔ 5 42 1 0.7565 0.981 0.000 (0;000) ✗ 27/01/17
NbCoTe2 COD 1005003 Cmce (64) ✔ 16 168 2 0.0 0.004 0.563 (0;000) ✗ 02/02/17
NbFeTe2 COD 1005004 Pmna (53) ✔ 16 132 2 0.0 0.010 0.595 (1;000) ✗ 02/02/17
Ta3N5 COD 1005006 Cmcm (63) ✔ 16 128 3 1.2557 1.519 0.000 (0;000) ✗ 02/02/17
Ca3AsN COD 1005008 Pnma (62) ✔ 20 160 1 0.8756 0.876 0.000 (0;000) ✗ 21/03/17
Ca3VN3 COD 1005013 Cmcm (63) ✔ 14 116 1 0.6765 0.984 0.000 (0;000) ✗ 02/02/17
Sr2ZnN2 COD 1005019 I4/mmm (139) ✔ 5 42 1 0.6805 0.681 0.000 (0;000) ✗ 27/01/17
Ba2ZnN2 COD 1005020 I4/mmm (139) ✔ 5 42 1 0.4276 0.537 0.000 (0;000) ✗ 05/01/17
K2Ni3S4 COD 1005023 Fddd (70) ✔ 18 144 1 0.7316 0.855 0.000 (0;000) ✗ 02/02/17
Sr3(GeN)2 COD 1005027 P2_1/m (11) ✔ 14 96 1 0.0 0.026 0.958 (0;000) ✗ 02/02/17
BaCoS2 COD 1005029 P4/nmm (129) ✔ 8 78 2 0.0 0.000 0.774 (1;000) ✗ 05/01/17
Ba3(GeN)2 COD 1005031 P2_1/m (11) ✔ 14 96 1 0.0 0.017 0.965 (0;010) ✗ 02/02/17
Ba2GaGeN COD 1005040 P2_1/m (11) ✔ 10 84 1 0.0 0.214 0.062 (0;000) ✗ 02/02/17
NaTa3N5 COD 1005042 Cmcm (63) ✔ 18 146 3 0.0 0.000 0.705 (1;110) ✗ 02/02/17
Ca3CrN3 COD 1005045 Cmcm (63) ✔ 14 118 1 0.0 0.000 0.509 (0;000) ✗ 02/02/17
BaCuN COD 1005050 C2/c (15) ✔ 18 156 3 0.0 0.029 0.020 (1;110) ✗ 02/02/17
KMnF4 COD 1006039 P2_1/c (14) ✔ 24 208 1 0.0 0.013 0.220 (0;000) ✗ 04/08/17
Cr2Ag2O7 COD 1007030 P-1 (2) ✔ 22 184 3 1.4107 1.484 0.000 (0;000) ✗ 07/08/17
Ag2CO3 COD 1007035 P2_1/m (11) ✔ 12 88 3 0.6496 1.356 0.000 (0;000) ✗ 27/01/17
BaNi2(AsO4)2 COD 1007068 R-3 (148) ✔ 13 88 2 0.0 0.001 0.194 (1;000) ✗ 05/01/17
Zn(PO3)2 COD 1007095 C2/c (15) ✔ 18 116 3 5.08 5.119 0.000 (0;000) ✗ 02/02/17
Ni2P2O7 COD 1007247 P2_1/c (14) ✔ 22 144 3 0.0 0.006 0.562 (1;010) ✗ 04/08/17
K2Sr(PO3)4 COD 1007253 I-4 (82) ✗ 19 120 1 5.7815 5.822 0.000 (0;000) ✗ 29/03/17
V4O7 COD 1008025 P-1 (2) ✔ 22 188 3 0.0 0.014 0.425 (0;011) ✗ 07/08/17
BaCa(FeO2)4 COD 1008057 P-31m (162) ✔ 14 100 2 0.0 0.000 0.787 (0;001) ✗ 05/01/17
Ni(RhSe2)2 COD 1008058 C2/m (12) ✔ 7 68 3 0.0 0.009 0.436 (0;111) ✗ 27/01/17
BaVS3 COD 1008062 P6_3/mmc (194) ✔ 10 82 1 0.0 0.000 0.424 (0;000) ✗ 02/02/17
TiTe2 COD 1008063 P-3m1 (164) ✔ 3 24 2 0.0 0.006 0.346 (0;000) ✗ 27/01/17
Rb3NaBe2F8 COD 1008068 P-3m1 (164) ✔ 14 100 1 6.6979 6.755 0.000 (0;000) ✗ 02/02/17
SrPd3O4 COD 1008074 Pm-3n (223) ✔ 16 176 3 0.0 0.029 0.123 (0;000) ✗ 27/01/17
CaPd3O4 COD 1008075 Pm-3n (223) ✔ 16 176 3 0.0 0.004 0.120 (0;000) ✗ 27/01/17
CdPd3O4 COD 1008076 Pm-3n (223) ✔ 16 180 3 0.0 0.000 0.125 (1;000) ✗ 27/01/17