≤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
SnGeS3 COD 9005509 P2_1/c (14) ✔ 20 144 3 1.3882 1.610 0.000 (0;000) ✗ 02/02/17
Ca2PdWO6 ICSD 83259 Pmm2 (25) ✗ 20 176 3 0.0 0.000 1.000 ? ✗ 21/03/17
CaZrO3 COD 1532747 Pnma (62) ✔ 20 128 3 3.4975 3.498 0.000 (0;000) ✗ 02/02/17
CaTiO3 COD 2310618 Pnma (62) ✔ 20 160 3 2.2046 2.205 0.000 (0;000) ✗ 02/02/17
CaTcO3 COD 4105648 Pnma (62) ✔ 20 172 0 0.0 0.000 0.313 (0;110) ✗ 02/02/17
CaVO3 COD 4336390 Pnma (62) ✔ 20 164 3 0.0 0.001 0.649 (0;110) ✗ 02/02/17
NbAlCl8 ICSD 62029 Cmcm (63) ✔ 20 144 1 2.1882 2.244 0.000 (0;000) ✗ 30/01/17
TiGeS3 COD 2236592 Pnma (62) ✔ 20 136 2 0.2854 0.340 0.000 (0;000) ✗ 02/02/17
CaZn(SiO3)2 COD 2014614 C2/c (15) ✔ 20 132 3 4.3367 4.435 0.000 (0;000) ✗ 02/02/17
Sr2CaReO6 ICSD 182568 P2_1/c (14) ✔ 20 162 1 0.0 0.000 0.974 (0;010) ✗ 02/02/17
Sr2CaTeO6 ICSD 414435 P2_1/c (14) ✔ 20 144 1 3.6612 3.716 0.000 (0;000) ✗ 02/02/17
Sr2CaWO6 COD 2104688 P2_1/c (14) ✔ 20 160 1 3.3236 3.434 0.000 (0;000) ✗ 02/02/17
LiVO3 ICSD 23477 Cc (9) ✗ 20 136 3 0.8008 0.885 0.000 (0;000) ✗ 29/03/17
KSiH3 ICSD 65954 Pnma (62) ✔ 20 64 1 2.4026 2.403 0.000 (0;000) ✗ 02/02/17
CaPS3 ICSD 405192 P2_1/c (14) ✔ 20 132 1 3.1376 3.138 0.000 (0;000) ✗ 02/02/17
MgB4 COD 1511477 Pnma (62) ✔ 20 88 3 0.2631 0.700 0.000 (0;000) ✗ 05/01/17
Y2S2O COD 4030480 P2_1/c (14) ✔ 20 160 3 2.5291 2.592 0.000 (0;000) ✗ 02/02/17
H2PbO2 ICSD 20701 Pnma (62) ✔ 20 112 3 1.7355 1.979 0.000 (0;000) ✗ 02/02/17
CaPSe3 ICSD 412765 P2_1/c (14) ✔ 20 132 1 2.2546 2.255 0.000 (0;000) ✗ 02/02/17
Na2LiAlF6 COD 2013037 P2_1/c (14) ✔ 20 132 1 7.3657 7.366 0.000 (0;000) ✗ 30/01/17
B4Mo ICSD 182095 P6_3/mmc (194) ✔ 20 104 3 0.0 0.002 0.542 (0;000) ✗ 05/01/17
SrHfS3 ICSD 638863 Pnma (62) ✔ 20 160 3 1.4451 1.445 0.000 (0;000) ✗ 02/02/17
SiH3I ICSD 65044 P2_1/c (14) ✔ 20 56 1 3.9747 4.155 0.000 (0;000) ✗ 02/02/17
Sr(HO)2 ICSD 15167 Pnma (62) ✔ 20 96 1 3.9041 4.028 0.000 (0;000) ✗ 02/02/17
YFe4(CuO4)3 ICSD 237749 Im3 (204) ✔ 20 148 3 0.0 0.000 0.880 (0;111) ✗ 27/01/17
NaMgH3 COD 1525701 Pnma (62) ✔ 20 88 1 3.2476 3.320 0.000 (0;000) ✗ 02/02/17
CaZnSiH2O5 ICSD 200432 Cc (9) ✗ 20 116 2 3.6898 3.739 0.000 (0;000) ✗ 21/03/17
Hf2Ni2Sn ICSD 407546 P4_2/mnm (136) ✔ 20 232 3 0.0 0.014 0.422 (0;000) ✗ 02/02/17
Na3AlF6 COD 9006163 P2_1/c (14) ✔ 20 144 1 6.5845 6.614 0.000 (0;000) ✗ 30/01/17
H4INO4 COD 2008618 I4_1/a (88) ✔ 20 80 1 2.8578 2.859 0.000 (0;000) ✗ 02/02/17
CaZrS3 ICSD 23286 Pnma (62) ✔ 20 128 3 1.0094 1.009 0.000 (0;000) ✗ 02/02/17
K2LiAlH6 ICSD 245318 R-3m (166) ✔ 20 60 1 2.586 2.909 0.000 (0;000) ✗ 30/01/17
ReH4NO4 ICSD 1394 I4_1/a (88) ✔ 20 96 1 4.2132 4.213 0.000 (0;000) ✗ 02/02/17
Cr2S3 COD 9007440 P-31c (163) ✔ 20 184 3 0.0 0.001 0.589 (0;000) ✗ 02/02/17
Sb2S2O COD 9012422 P-1 (2) ✔ 20 112 2 0.0 1.072 1.000 (0;000) ✗ 02/02/17
Hf3Ni7 ICSD 2417 P-1 (2) ✔ 20 212 3 0.0 0.019 0.727 (0;110) ✗ 02/02/17
BaCO3 COD 1011149 Pnma (62) ✔ 20 128 2 4.4216 4.463 0.000 (0;000) ✗ 02/02/17
CBr3F ICSD 72370 Pnma (62) ✔ 20 128 1 3.4942 3.524 0.000 (0;000) ✗ 02/02/17
BaCO3 COD 9006846 Pnma (62) ✔ 20 128 1 4.2133 4.219 0.000 (0;000) ✗ 02/02/17
Hf3P2 COD 2005341 Pnma (62) ✔ 20 184 3 0.0 0.020 0.449 (1;000) ✗ 02/02/17
PtCCl2O COD 2102529 P4_2/m (84) ✔ 20 136 2 1.4271 1.435 0.000 (0;000) ✗ 02/02/17
CaCO3 COD 2106394 P2_1/c (14) ✔ 20 128 1 4.9865 5.058 0.000 (0;000) ✗ 02/02/17
CaCO3 ICSD 186772 P-1 (2) ✔ 20 128 1 3.6119 3.614 0.000 (0;000) ✗ 02/02/17
CaCO3 COD 9016600 Pnma (62) ✔ 20 128 1 3.8664 3.866 0.000 (0;000) ✗ 02/02/17
CaCO3 COD 9016547 Pnma (62) ✔ 20 128 1 4.3434 4.687 0.000 (0;000) ✗ 02/02/17
CaMnO3 ICSD 92083 Pnma (62) ✔ 20 172 3 0.0 0.001 0.550 (0;110) ✗ 22/03/17
HfSnS3 ICSD 65667 Pnma (62) ✔ 20 176 2 1.0307 1.041 0.000 (0;000) ✗ 02/02/17
Cd2PCl2 ICSD 412647 P2_1/c (14) ✔ 20 172 3 1.6678 1.668 0.000 (0;000) ✗ 02/02/17
TiCl4 COD 9007929 P2_1/c (14) ✔ 20 160 1 3.374 3.414 0.000 (0;000) ✗ 07/08/17
CaRuO3 ICSD 165689 Pnma (62) ✔ 20 176 3 0.0 0.015 0.253 (0;000) ✗ 22/03/17
CSCl2O COD 7050458 P2_1/c (14) ✔ 20 120 1 3.0161 3.088 0.000 (0;000) ✗ 02/02/17
SrHfO3 COD 1521390 Pnma (62) ✔ 20 160 3 4.2339 4.290 0.000 (0;000) ✗ 02/02/17
HfI4 ICSD 200826 C2/c (15) ✔ 20 160 2 1.8004 1.800 0.000 (0;000) ✗ 02/02/17
CdBiSe2Br ICSD 171726 Pnma (62) ✔ 20 184 3 1.0754 1.079 0.000 (0;000) ✗ 02/02/17
HfPbS3 ICSD 65668 Pnma (62) ✔ 20 176 3 1.2292 1.329 0.000 (0;000) ✗ 02/02/17
AlSiP3 ICSD 10032 Pnma (62) ✔ 20 88 3 0.276 1.258 0.000 (0;000) ✗ 30/01/17
YAlO3 COD 1533069 Pnma (62) ✔ 20 128 3 5.6486 5.665 0.000 (0;000) ✗ 30/01/17
PbCSNCl ICSD 409835 Pnma (62) ✔ 20 144 2 2.4437 2.444 0.000 (0;000) ✗ 02/02/17
HgCSNCl ICSD 409579 Pnma (62) ✔ 20 136 3 2.6253 2.625 0.000 (0;000) ✗ 02/02/17
Mg3Ru2 COD 1523080 P4_132 (213) ✗ 20 248 3 0.0 0.000 0.508 ? ✗ 29/03/17
TlCdCl3 ICSD 39807 Pnma (62) ✔ 20 184 2 2.8952 2.896 0.000 (0;000) ✗ 02/02/17
Sc7CoBr12 ICSD 424474 R-3 (148) ✔ 20 178 3 0.1021 0.145 0.000 (0;000) ✗ 02/02/17
BiClF8 ICSD 39555 P-1 (2) ✔ 20 156 1 2.8713 2.871 0.000 (0;000) ✗ 02/02/17
Na5InO4 ICSD 69630 Pmmn (59) ✔ 20 164 1 1.8792 1.879 0.000 (0;000) ✗ 02/02/17
Ni3Sn2 COD 1523294 Pnma (62) ✔ 20 232 3 0.0 0.012 0.513 (1;000) ✗ 02/02/17
Sc7CoCl12 ICSD 424476 R-3 (148) ✔ 20 178 3 0.1088 0.149 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
YCrO3 ICSD 236372 Pnma (62) ✔ 20 172 3 0.0 0.001 0.458 (0;110) ✗ 02/02/17
RbCdCl3 COD 1530478 Pnma (62) ✔ 20 168 1 3.7589 3.876 0.000 (0;000) ✗ 02/02/17
Ba2GeAs2 ICSD 35151 P2_1/c (14) ✔ 20 136 1 0.5906 0.728 0.000 (0;000) ✗ 30/01/17
CdNCl3 COD 9014544 Pnma (62) ✔ 20 152 2 0.0 0.005 0.361 (0;000) ✗ 02/02/17
KCdCl3 ICSD 33281 Pnma (62) ✔ 20 168 2 3.676 3.816 0.000 (0;000) ✗ 02/02/17
ZrTlCdF7 ICSD 245784 Cmcm (63) ✔ 20 156 3 4.8717 4.872 0.000 (0;000) ✗ 02/02/17
RbZrCdF7 ICSD 245783 Cmcm (63) ✔ 20 148 3 5.4062 5.487 0.000 (0;000) ✗ 02/02/17
Na3Hg2 COD 2310237 P4_2/mnm (136) ✔ 20 204 3 0.0 0.013 0.574 (0;000) ✗ 02/02/17
CdSbS2Cl ICSD 171722 Pnma (62) ✔ 20 144 3 1.54 1.566 0.000 (0;000) ✗ 02/02/17
Ba(ZnAs)2 COD 7221354 Pnma (62) ✔ 20 176 3 0.1744 0.174 0.000 (0;000) ✗ 30/01/17
KCdF3 COD 1530090 Pnma (62) ✔ 20 168 3 3.3039 3.304 0.000 (0;000) ✗ 02/02/17
N2O3 ICSD 80890 P2_12_12_1 (19) ✗ 20 112 1 1.128 1.175 0.000 (0;000) ✗ 29/03/17
Cr(OF)2 COD 4339750 P2_1/c (14) ✔ 20 160 2 2.262 2.278 0.000 (0;000) ✗ 07/08/17
Ba(GaAs)2 COD 4316405 P2_1/c (14) ✔ 20 184 1 1.3257 1.368 0.000 (0;000) ✗ 30/01/17
Mn3Sn2 ICSD 169060 Pnma (62) ✔ 20 292 3 0.0 0.000 0.722 (0;101) ✗ 29/03/17
Y2C3 ICSD 77572 I-43d (220) ✗ 20 136 3 0.0 0.009 0.422 ? ✗ 21/03/17
CdGeO3 COD 1530775 C2/c (15) ✔ 20 136 3 1.7048 1.761 0.000 (0;000) ✗ 02/02/17
Tl3BiCl6 ICSD 421317 P4_2/m (84) ✔ 20 192 1 2.1717 2.297 0.000 (0;000) ✗ 02/02/17
HgTeO3 ICSD 61673 P-1 (2) ✔ 20 144 3 2.3102 2.493 0.000 (0;000) ✗ 02/02/17
CdHg2SO6 ICSD 413287 P-1 (2) ✔ 20 156 3 1.5314 1.669 0.000 (0;000) ✗ 02/02/17
CdGeO3 COD 9005881 Pnma (62) ✔ 20 136 3 1.2811 1.281 0.000 (0;000) ✗ 02/02/17
CdHg2SeO6 ICSD 413288 P-1 (2) ✔ 20 156 3 1.2137 1.289 0.000 (0;000) ✗ 02/02/17
K2HgS2 ICSD 74500 Pbcm (57) ✔ 20 168 1 2.2608 2.261 0.000 (0;000) ✗ 02/02/17
TlCdI3 ICSD 8009 Pnma (62) ✔ 20 184 2 1.8407 1.934 0.000 (0;000) ✗ 02/02/17
HgSeO3 COD 2003568 Pnma (62) ✔ 20 144 3 2.4044 2.476 0.000 (0;000) ✗ 02/02/17
Sr(GaAs)2 ICSD 422527 P2/m (10) ✔ 20 184 3 0.2417 0.242 0.000 (0;000) ✗ 30/01/17
HgSeO3 ICSD 412548 P2_1/c (14) ✔ 20 144 3 2.3972 2.828 0.000 (0;000) ✗ 02/02/17
Li4MoO5 ICSD 40270 P-1 (2) ✔ 20 112 3 0.0 0.010 0.282 (0;000) ✗ 27/01/17
Li4SeO5 ICSD 410714 C2/c (15) ✔ 20 96 1 2.9133 3.020 0.000 (0;000) ✗ 27/01/17
HgSeO3 ICSD 412547 P2_1/c (14) ✔ 20 144 3 2.5801 2.712 0.000 (0;000) ✗ 02/02/17
KSb(PS3)2 COD 8100520 P2_1 (4) ✗ 20 120 2 2.212 2.233 0.000 (0;000) ✗ 29/03/17
S(OF)2 ICSD 62968 P4_12_12 (92) ✗ 20 128 1 6.6222 6.639 0.000 (0;000) ✗ 22/03/17
Rb2CdO2 ICSD 62054 Pbcn (60) ✔ 20 168 3 1.5349 1.556 0.000 (0;000) ✗ 02/02/17