≤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
Li2ZnCl4 ICSD 402398 Fd-3m (227) ✔ 14 92 2 4.2131 4.213 0.000 (0;000) ✗ 02/02/17
Na2MgCl4 ICSD 69343 Pbam (55) ✔ 14 112 1 4.8587 4.859 0.000 (0;000) ✗ 02/02/17
Zr3(SiCu2)2 ICSD 26260 P-62m (189) ✗ 9 64 3 0.0 0.012 0.272 ? ✗ 06/10/16
BaRh2 ICSD 108149 Fd-3m (227) ✔ 6 88 3 0.0 0.007 0.591 (0;000) ✗ 05/01/17
BaS2 ICSD 42134 C2/c (15) ✔ 6 44 1 1.5646 1.599 0.000 (0;000) ✗ 05/01/17
PNF2 ICSD 9684 Cmc2_1 (36) ✗ 8 48 1 6.3002 6.301 0.000 (0;000) ✗ 06/10/16
PbCClO2 ICSD 99805 C2/m (12) ✔ 10 74 2 2.7433 2.837 0.000 (0;000) ✗ 27/01/17
Na2TiCl4 ICSD 400264 Pbam (55) ✔ 14 116 1 0.0 0.012 0.435 (0;000) ✗ 02/02/17
BaSe ICSD 52695 Pm-3m (221) ✔ 2 16 1 0.8463 0.846 0.000 (0;000) ✗ 05/01/17
VNCl4 ICSD 28128 P-1 (2) ✔ 12 92 1 1.1219 1.234 0.000 (0;000) ✗ 02/02/17
Sc4OsCl4 ICSD 421532 C2/c (15) ✔ 18 176 3 0.5396 0.584 0.000 (0;000) ✗ 02/02/17
InI ICSD 38129 Ccmm (63) ✔ 4 40 3 1.1696 1.170 0.000 (0;000) ✗ 06/10/16
Sn2IF3 ICSD 2419 C222_1 (20) ✗ 12 112 1 2.2326 2.389 0.000 (0;000) ✗ 06/10/16
NaMgF3 ICSD 156158 Cmc2_1 (36) ✗ 10 80 3 9.1855 9.189 0.000 (0;000) ✗ 06/10/16
SiCl4 ICSD 62279 P2_1/c (14) ✔ 20 128 1 5.7206 5.794 0.000 (0;000) ✗ 02/02/17
SnCl4 ICSD 411242 P2_1/c (14) ✔ 20 168 1 3.5749 3.575 0.000 (0;000) ✗ 02/02/17
SrZnCl4 ICSD 410191 I4_1/a (88) ✔ 12 100 1 4.4129 4.413 0.000 (0;000) ✗ 02/02/17
TaCl4 ICSD 402406 C2/m (12) ✔ 10 82 1 1.0671 1.181 0.000 (0;000) ✗ 02/02/17
ZrCl4 ICSD 26049 P2/c (13) ✔ 10 64 1 3.4913 3.573 0.000 (0;000) ✗ 02/02/17
Ba(ZnSi)2 ICSD 174269 I4/mmm (139) ✔ 5 42 3 0.0 0.005 0.274 (1;000) ✗ 05/01/17
SiO2 ICSD 154289 P3_121 (152) ✗ 9 48 3 5.9953 6.285 0.000 (0;000) ✗ 06/10/16
Cs3MnCl5 ICSD 24 I4/mcm (140) ✔ 18 154 1 0.0 0.000 0.337 (1;111) ✗ 02/02/17
InI ICSD 55181 Cmcm (63) ✔ 4 40 3 0.7644 0.832 0.000 (0;000) ✗ 06/10/16
K2HfF6 ICSD 47246 P-62m (189) ✗ 9 72 1 5.3771 5.412 0.000 (0;000) ✗ 06/10/16
BaSn5 ICSD 107305 P6/mmm (191) ✔ 6 80 2 0.0 0.010 0.705 (1;001) ✗ 05/01/17
TlI ICSD 26761 Ccmm (63) ✔ 4 40 2 1.4715 1.656 0.000 (0;000) ✗ 06/10/16
Hf6Ga2Fe ICSD 631770 P-62m (189) ✗ 9 106 3 0.0 0.000 0.901 ? ✗ 06/10/16
MoS2N2Cl5 ICSD 47102 P-1 (2) ✔ 20 142 1 0.5529 0.644 0.000 (0;000) ✗ 02/02/17
BaTe ICSD 616162 Pm-3m (221) ✔ 2 16 1 0.4495 0.532 0.000 (0;000) ✗ 05/01/17
SbCl5 ICSD 412111 P6_3/mmc (194) ✔ 12 80 1 1.8539 1.854 0.000 (0;000) ✗ 02/02/17
Na3CrCl6 ICSD 62035 P-31c (163) ✔ 20 166 1 0.0 0.000 0.176 (1;000) ✗ 02/02/17
Zr6Ga2Fe ICSD 631856 P-62m (189) ✗ 9 58 3 0.0 0.000 0.879 ? ✗ 06/10/16
Cs2HgPdCl6 ICSD 36616 I4/mmm (139) ✔ 10 90 2 1.417 1.502 0.000 (0;000) ✗ 02/02/17
Cs2KScCl6 ICSD 59196 Fm-3m (225) ✔ 10 80 3 3.2291 3.229 0.000 (0;000) ✗ 02/02/17
Cs2LiYCl6 ICSD 65731 Fm-3m (225) ✔ 10 74 2 4.9066 4.907 0.000 (0;000) ✗ 02/02/17
BaTl2 ICSD 58681 P6_3/mmc (194) ✔ 6 72 3 0.0 0.027 0.062 (0;000) ✗ 05/01/17
Cs2NaYCl6 ICSD 245354 Fm-3m (225) ✔ 10 80 2 5.0966 5.097 0.000 (0;000) ✗ 02/02/17
BaZn2 ICSD 58683 Imma (74) ✔ 6 68 3 0.0 0.006 0.471 (0;111) ✗ 05/01/17
AgBr ICSD 56549 P2_1/m (11) ✔ 4 36 3 0.3803 1.889 0.000 (0;000) ✔ 06/10/16
Sn3As4 ICSD 163834 P-43m (215) ✗ 7 62 3 0.3902 0.463 0.000 (0;000) ✔ 06/10/16
CuN ICSD 161756 F-43m (216) ✗ 2 16 3 0.0 0.009 0.871 (0;000) ✔ 06/10/16
SiO2 ICSD 162612 P6_222 (180) ✗ 9 48 3 5.633 5.840 0.000 (0;000) ✗ 06/10/16
PdI2 ICSD 23169 Pnnm (58) ✔ 6 64 1 0.6718 0.969 0.000 (0;000) ✗ 02/02/17
HfFeGe ICSD 23577 P-62m (189) ✗ 9 72 3 0.0 0.000 0.800 ? ✗ 06/10/16
PCl5 ICSD 76731 C2/m (12) ✔ 18 120 1 2.0426 2.128 0.000 (0;000) ✗ 02/02/17
BaZn ICSD 616171 Pm-3m (221) ✔ 2 22 1 0.0 0.000 0.663 (1;000) ✗ 05/01/17
HfFeGe ICSD 632036 P-62m (189) ✗ 9 72 3 0.0 0.000 0.800 ? ✗ 06/10/16
HfFeCl6 ICSD 39817 P-31c (163) ✔ 16 124 2 0.7637 0.783 0.000 (0;000) ✗ 02/02/17
K3NaFeCl6 ICSD 23182 R-3m (166) ✔ 11 86 1 0.8954 0.895 0.000 (0;000) ✗ 02/02/17
ZrFeCl6 ICSD 39666 P-31c (163) ✔ 16 108 2 0.7473 0.778 0.000 (0;000) ✗ 02/02/17
H8Pt(NCl3)2 ICSD 97927 Fm-3m (225) ✔ 17 70 1 1.6827 1.683 0.000 (0;000) ✗ 02/02/17
SnH8(NCl3)2 ICSD 9021 Fm-3m (225) ✔ 17 74 1 2.697 2.697 0.000 (0;000) ✗ 02/02/17
Be2BO3F ICSD 56847 C2/c (15) ✔ 14 72 1 6.1761 6.176 0.000 (0;000) ✗ 05/01/17
Hf(Te2Cl3)2 ICSD 401589 P-1 (2) ✔ 11 78 1 1.1606 1.187 0.000 (0;000) ✗ 02/02/17
Na3InCl6 ICSD 154092 P-31c (163) ✔ 20 164 1 4.0782 4.095 0.000 (0;000) ✗ 02/02/17
K2MoCl6 ICSD 26643 Fm-3m (225) ✔ 9 74 1 0.0 0.000 0.352 (0;000) ✗ 02/02/17
K2NbCl6 ICSD 245749 P4/mnc (128) ✔ 18 146 1 0.0 0.000 0.921 (0;000) ✗ 02/02/17
LaI3 ICSD 31596 Cmcm (63) ✔ 8 48 2 1.1147 1.359 0.000 (0;000) ✗ 06/10/16
NaFeS2 ICSD 37026 I222 (23) ✗ 8 58 1 0.0 0.010 0.239 (0;000) ✔ 06/10/16
K2RuCl6 ICSD 8055 Fm-3m (225) ✔ 9 76 1 0.0 0.124 0.653 (0;000) ✗ 02/02/17
Mg2BBrN2 ICSD 261620 C2/c (15) ✔ 12 80 3 3.4236 3.781 0.000 (0;000) ✗ 05/01/17
Sr2BBrN2 ICSD 261795 R-3m (166) ✔ 6 40 1 2.4699 2.958 0.000 (0;000) ✗ 05/01/17
NbFeO4 ICSD 429 C2 (5) ✗ 12 90 3 0.0 0.010 0.796 ? ✗ 06/10/16
K2TiCl6 ICSD 26934 Fm-3m (225) ✔ 9 72 1 2.069 2.082 0.000 (0;000) ✗ 02/02/17
K2WCl6 ICSD 409840 Fm-3m (225) ✔ 9 74 1 0.0 0.000 0.384 (0;000) ✗ 02/02/17
SiO2 ICSD 162660 I-42d (122) ✗ 6 32 3 5.8944 5.894 0.000 (0;000) ✗ 06/10/16
Tl2MoCl6 ICSD 408777 Fm-3m (225) ✔ 9 82 1 0.0 0.000 0.795 (0;000) ✗ 02/02/17
FeMoClO4 ICSD 202186 P4/nmm (129) ✔ 14 106 3 0.0 0.000 0.921 (1;000) ✗ 02/02/17
SbI3 ICSD 26082 R-3 (148) ✔ 8 52 2 1.7182 1.827 0.000 (0;000) ✗ 02/02/17
TiFeO3 ICSD 246515 R3c (161) ✗ 10 76 3 0.2475 0.296 0.000 (0;000) ✔ 06/10/16
LiCdBO3 ICSD 200615 P-1 (2) ✔ 12 72 3 2.6621 2.727 0.000 (0;000) ✗ 05/01/17
FeCo2B ICSD 603579 Pnma (62) ✔ 16 180 3 0.0 0.000 0.387 (0;110) ✗ 05/01/17
TiFeO3 ICSD 79278 R3c (161) ✗ 10 76 3 0.5011 0.525 0.000 (0;000) ✗ 06/10/16
Na3ScCl6 ICSD 166749 P2_1/c (14) ✔ 20 160 1 4.0856 4.103 0.000 (0;000) ✗ 02/02/17
Na3TiCl6 ICSD 411050 P2_1/c (14) ✔ 20 162 1 0.0 0.000 0.724 (0;000) ✗ 02/02/17
YFeCo3B ICSD 613036 P6/mmm (191) ✔ 12 146 3 0.0 0.002 0.638 (1;001) ✗ 05/01/17
NaSbCl6 ICSD 36517 P4_2/m (84) ✔ 16 112 1 2.3564 2.356 0.000 (0;000) ✗ 02/02/17
SbS2NCl6 ICSD 2441 Immm (71) ✔ 10 64 1 1.8567 1.857 0.000 (0;000) ✗ 02/02/17
Pd(PbCl3)2 ICSD 78873 P2_1/c (14) ✔ 18 176 3 1.4312 1.530 0.000 (0;000) ✗ 02/02/17
YI3 ICSD 170773 R-3 (148) ✔ 8 64 2 2.4263 2.773 0.000 (0;000) ✗ 06/10/16
ICl ICSD 26032 P2_1/c (14) ✔ 16 112 1 0.0 0.196 0.034 (0;000) ✗ 02/02/17
FeSiO4 ICSD 186518 P2_1nm (31) ✗ 12 72 2 0.0 0.025 0.586 (0;000) ✔ 06/10/16
Pd(SCl3)2 ICSD 39434 P-1 (2) ✔ 9 72 1 1.4965 1.500 0.000 (0;000) ✗ 02/02/17
Pd(SeCl3)2 ICSD 39435 C2/c (15) ✔ 18 144 1 1.6214 1.627 0.000 (0;000) ✗ 02/02/17
Ti3FeO7 ICSD 190042 Imm2 (44) ✗ 11 86 3 0.0 0.026 0.691 ? ✗ 06/10/16
Pt(SCl3)2 ICSD 66013 P-1 (2) ✔ 9 64 1 1.6439 1.676 0.000 (0;000) ✗ 02/02/17
C3N4 ICSD 248430 P-6 (174) ✗ 7 32 1 0.0 0.001 0.871 (0;000) ✔ 06/10/16
SiO2 ICSD 170510 I4_122 (98) ✗ 12 64 3 5.05 5.050 0.000 (0;000) ✗ 06/10/16
K2S ICSD 412535 Cmcm (63) ✔ 6 48 1 2.7895 2.790 0.000 (0;000) ✗ 27/01/17
Fe(Si2O3)2 ICSD 34181 P1 (1) ✗ 11 60 1 0.0 0.022 0.092 (0;000) ✔ 06/10/16
Fe(SiP)4 ICSD 79005 P1 (1) ✗ 9 44 3 1.0026 1.287 0.000 (0;000) ✗ 06/10/16
Be12Cr ICSD 150599 I4/mmm (139) ✔ 13 62 1 0.0 0.010 0.513 (1;111) ✗ 05/01/17
Be12Fe ICSD 616264 I4/mmm (139) ✔ 13 56 1 0.0 0.002 0.723 (1;111) ✗ 05/01/17
PI2 ICSD 203216 P-1 (2) ✔ 6 38 1 1.5597 1.560 0.000 (0;000) ✗ 06/10/16
FeSbPt ICSD 103606 P2_13 (198) ✗ 12 92 3 0.0 0.000 0.320 ? ✗ 06/10/16
Ta(TeCl3)2 ICSD 401907 P-1 (2) ✔ 18 134 1 1.1359 1.136 0.000 (0;000) ✗ 02/02/17
Be12Mo ICSD 616334 I4/mmm (139) ✔ 13 62 1 0.0 0.009 0.485 (1;000) ✗ 05/01/17
Tl2WCl6 ICSD 409229 Fm-3m (225) ✔ 9 82 1 0.0 0.000 0.836 (0;000) ✗ 02/02/17
K3Mn2Cl7 ICSD 36127 I4/mmm (139) ✔ 12 106 2 0.0 0.004 0.851 (0;000) ✗ 02/02/17
MoSeCl7O ICSD 410101 P-1 (2) ✔ 20 150 3 0.0 0.006 0.133 (1;100) ✗ 02/02/17