≤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
Ba2ZnF6 ICSD 21054 I4/mmm (139) ✔ 9 74 1 4.9269 5.772 0.000 (0;000) ✗ 05/01/17
BaZrSe3 ICSD 616136 P6_3/mmc (194) ✔ 10 64 1 0.0 0.005 0.254 (0;000) ✗ 02/02/17
TeRhCl ICSD 405714 Cm (8) ✗ 6 60 2 0.7234 0.728 0.000 (0;000) ✗ 06/10/16
Ba(ZnSn)2 ICSD 25339 P4/nmm (129) ✔ 10 124 3 0.0 0.019 0.428 (1;000) ✗ 02/02/17
Ba2FeWO6 ICSD 99061 Fm-3m (225) ✔ 10 78 3 0.3613 0.364 0.000 (0;000) ✗ 05/01/17
Ba2NF ICSD 262049 R-3m (166) ✔ 4 32 1 0.9466 0.947 0.000 (0;000) ✗ 05/01/17
BaTe2 ICSD 80280 I4/mcm (140) ✔ 6 44 1 0.3666 1.130 0.000 (0;000) ✗ 02/02/17
BaZn5 ICSD 616174 Cmcm (63) ✔ 12 140 3 0.0 0.005 0.532 (1;110) ✗ 02/02/17
Ba3BPO3 ICSD 402017 P6_3/mmc (194) ✔ 16 112 1 1.4131 1.767 0.000 (0;000) ✗ 02/02/17
Nb2O5 ICSD 25765 C2/m (12) ✔ 7 56 3 2.6685 3.191 0.000 (0;000) ✗ 27/01/17
BaGaBO3F2 ICSD 91315 P6_3/m (176) ✔ 16 116 2 5.2302 5.579 0.000 (0;000) ✗ 02/02/17
Ni2Ge ICSD 637346 P6_3/mmc (194) ✔ 6 48 3 0.0 0.005 0.733 (0;000) ✗ 06/10/16
Cr(ClO)2 ICSD 416750 P2_1 (4) ✗ 10 80 1 0.0 2.337 1.000 ? ✗ 06/10/16
Ba2HfS4 ICSD 80652 I4/mmm (139) ✔ 7 56 2 0.8433 0.897 0.000 (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
Ba2Hg ICSD 30084 I4/mmm (139) ✔ 3 32 2 0.0 0.044 0.609 (0;111) ✗ 05/01/17
S(ClO)2 ICSD 62970 F2dd (43) ✗ 10 64 1 4.2223 4.232 0.000 (0;000) ✗ 06/10/16
Cr5Si3B ICSD 613552 P6_3/mcm (193) ✔ 18 170 3 0.0 0.000 0.921 (0;000) ✗ 02/02/17
Ba2NbInO6 ICSD 99698 Fm-3m (225) ✔ 10 82 3 3.7079 3.781 0.000 (0;000) ✗ 05/01/17
CsNa2BO3 ICSD 67524 Pmmn (59) ✔ 14 96 1 3.5967 3.648 0.000 (0;000) ✗ 02/02/17
GeO2 ICSD 158598 Pmnn (58) ✔ 6 32 3 3.2329 3.286 0.000 (0;000) ✗ 06/10/16
CsGeCl3 ICSD 23121 R3 (146) ✗ 5 34 1 2.3076 2.309 0.000 (0;000) ✗ 28/10/16
Be2Ru ICSD 616410 P6_3/mmc (194) ✔ 12 96 1 0.0 0.003 0.511 (0;000) ✗ 02/02/17
Bi ICSD 187502 Cmce (64) ✔ 8 120 3 0.0 0.028 0.332 (0;000) ✗ 02/02/17
Ba2TaInO6 ICSD 189520 Fm-3m (225) ✔ 10 82 3 4.0575 4.058 0.000 (0;000) ✗ 05/01/17
ZnO ICSD 190807 Fm-3m (225) ✔ 2 18 3 0.9046 2.298 0.000 (0;000) ✗ 27/01/17
Cs3LiCl4 ICSD 245969 Cm2m (38) ✗ 8 58 1 4.5309 4.531 0.000 (0;000) ✗ 28/10/16
BaP8 ICSD 96544 P-1 (2) ✔ 18 100 1 0.7672 1.147 0.000 (0;000) ✗ 02/02/17
Ba2YIrO6 ICSD 152679 Fm-3m (225) ✔ 10 84 3 0.0 0.346 0.323 (0;000) ✗ 05/01/17
K2BeO2 ICSD 23633 P2_1/c (14) ✔ 20 136 3 3.1261 3.253 0.000 (0;000) ✗ 02/02/17
K4BeP2 ICSD 300110 R-3m (166) ✔ 7 50 1 1.1639 1.189 0.000 (0;000) ✗ 02/02/17
Ba2LiReO6 ICSD 109259 Fm-3m (225) ✔ 10 74 1 1.8305 1.905 0.000 (0;000) ✗ 05/01/17
TlAs ICSD 184574 F-43m (216) ✗ 2 18 3 0.0 0.000 0.142 (1;000) ✔ 04/10/16
Nb5Ge2B ICSD 614401 I4/mcm (140) ✔ 16 152 3 0.0 0.007 0.332 (1;111) ✗ 02/02/17
Nb5Ge3B ICSD 614400 P6_3/mcm (193) ✔ 18 160 3 0.0 0.013 0.619 (1;000) ✗ 02/02/17
Ta5Ge3B ICSD 614404 P6_3/mcm (193) ✔ 18 160 3 0.0 0.003 0.571 (1;000) ✗ 02/02/17
V5Ge3B ICSD 614407 P6_3/mcm (193) ✔ 18 160 3 0.0 0.012 0.420 (1;000) ✗ 02/02/17
TaAs2 ICSD 107966 C2 (5) ✗ 6 46 3 0.0 0.011 0.322 (1;110) ✔ 04/10/16
InBi2Se4Br ICSD 159465 C2/m (12) ✔ 16 148 3 0.9314 0.934 0.000 (0;000) ✗ 02/02/17
P3Au2 ICSD 8058 C2/m (12) ✔ 10 74 3 0.0 0.089 0.119 (1;100) ✔ 04/10/16
TlBi2Cl7 ICSD 421318 P-1 (2) ✔ 20 184 3 2.7397 2.804 0.000 (0;000) ✗ 02/02/17
Hg3Bi2(SCl4)2 ICSD 237618 C2/m (12) ✔ 15 134 3 2.5966 2.597 0.000 (0;000) ✗ 02/02/17
Ti4CoBi2 ICSD 150147 I4/mcm (140) ✔ 14 190 3 0.0 0.000 0.920 (1;111) ✗ 02/02/17
Cs2NiBi2 ICSD 658704 Cmcm (63) ✔ 10 116 3 0.3142 0.314 0.000 (0;000) ✗ 02/02/17
Cs2Bi2Pd ICSD 658703 Cmcm (63) ✔ 10 132 3 0.4422 0.496 0.000 (0;000) ✗ 02/02/17
Cs2Bi2Pt ICSD 658701 Cmcm (63) ✔ 10 116 3 0.6288 0.810 0.000 (0;000) ✗ 02/02/17
CrP4 ICSD 2790 C2/c (15) ✔ 10 68 2 0.0 0.022 0.114 (1;000) ✔ 27/01/17
CsBi2 ICSD 58771 Fd-3m (227) ✔ 6 78 3 0.0 0.000 0.599 (0;000) ✗ 02/02/17
Ge(BiTe2)2 ICSD 30394 R-3m (166) ✔ 7 58 3 0.0 0.174 0.007 (1;111) ✗ 02/02/17
TaSb2 ICSD 651600 C2/m (12) ✔ 6 46 3 0.0 0.098 0.168 (0;111) ✔ 27/01/17
Bi2Ir ICSD 616739 P2_1/c (14) ✔ 12 188 3 0.0 0.154 0.167 (0;000) ✗ 02/02/17
Mg(BiO3)2 ICSD 50005 P4_2/mnm (136) ✔ 18 152 3 0.0 0.008 0.035 (0;000) ✗ 02/02/17
MnNi(BiO3)2 ICSD 153857 P2_1/c (14) ✔ 20 182 3 0.0 0.000 0.877 (0;000) ✗ 02/02/17
Mn(BiSe2)2 ICSD 603311 C2/m (12) ✔ 14 138 3 0.0 0.000 0.138 (0;110) ✗ 02/02/17
Ti4MnBi2 ICSD 150145 I4/mcm (140) ✔ 14 186 3 0.0 0.000 0.573 (1;111) ✗ 02/02/17
Bi2MoO6 ICSD 37251 Cmce (64) ✔ 18 160 3 0.3995 0.401 0.000 (0;000) ✗ 02/02/17
As2Ir ICSD 42573 P2_1/c (14) ✔ 12 76 3 0.9232 1.038 0.000 (0;000) ✗ 06/10/16
Ti4NiBi2 ICSD 150148 I4/mcm (140) ✔ 14 176 3 0.0 0.001 0.464 (0;000) ✗ 02/02/17
SiC ICSD 107204 P3m1 (156) ✗ 10 40 3 1.7282 2.854 0.000 (0;000) ✗ 06/10/16
Nb2O5 ICSD 51176 C2 (5) ✗ 7 56 3 0.0 0.431 0.107 (0;000) ✔ 06/10/16
GePd ICSD 659798 Pmnb (62) ✔ 8 56 3 0.0 0.023 0.396 (0;000) ✗ 06/10/16
Sr(BiO2)2 ICSD 80668 C2/m (12) ✔ 14 128 1 0.3368 0.827 0.000 (0;000) ✗ 02/02/17
Bi2TeO6 ICSD 6239 Cmce (64) ✔ 18 144 3 1.7449 1.745 0.000 (0;000) ✗ 02/02/17
Bi2Pb2Se5 ICSD 30372 P-3m1 (164) ✔ 9 88 3 0.0977 0.215 0.000 (1;000) ✗ 02/02/17
Bi2Te5Pb2 ICSD 42708 P-3m1 (164) ✔ 9 88 3 0.0 0.002 0.115 (1;000) ✗ 02/02/17
Bi2Te4Pb ICSD 616936 R-3m (166) ✔ 7 68 3 0.0449 0.134 0.000 (1;111) ✗ 02/02/17
Sr(BiPd)2 ICSD 604338 P4/nmm (129) ✔ 10 152 3 0.0 0.010 0.832 (0;000) ✗ 02/02/17
Bi2Pd3S2 ICSD 616954 C2/m (12) ✔ 14 192 3 0.0 0.056 0.857 (1;111) ✗ 02/02/17
Bi2Pd3Se2 ICSD 261457 C2/m (12) ✔ 14 192 3 0.0 0.096 0.791 (0;110) ✗ 02/02/17
ReNCl4 ICSD 10126 P1 (1) ✗ 6 48 1 1.098 1.204 0.000 (0;000) ✗ 06/10/16
Bi2Rh3S2 ICSD 420725 C2/m (12) ✔ 14 186 3 0.0 0.021 0.395 (0;001) ✗ 02/02/17
Si2Bi2Rh3 ICSD 617015 C2/m (12) ✔ 14 178 3 0.0 0.035 0.679 (0;001) ✗ 02/02/17
Ba2MgTeO6 ICSD 191563 Fm-3m (225) ✔ 10 72 3 2.0974 2.097 0.000 (0;000) ✗ 05/01/17
Ba2MgWO6 ICSD 152572 Fm-3m (225) ✔ 10 80 3 2.7544 2.831 0.000 (0;000) ✗ 05/01/17
ReNCl4 ICSD 419181 I4 (79) ✗ 6 48 2 1.0756 1.276 0.000 (0;000) ✗ 06/10/16
SrZnBi2 ICSD 41924 I4/mmm (139) ✔ 8 104 1 0.0 0.031 0.134 (0;000) ✗ 02/02/17
Bi3Se4Br ICSD 411096 C2/m (12) ✔ 16 152 3 0.5735 0.606 0.000 (0;000) ✗ 02/02/17
Ba2MnReO6 ICSD 109256 Fm-3m (225) ✔ 10 86 3 0.0 0.167 0.107 (0;000) ✗ 05/01/17
Ba2NiMoO6 ICSD 98192 Fm-3m (225) ✔ 10 80 3 0.0 0.000 0.784 (0;000) ✗ 05/01/17
In4Bi3Pb ICSD 616725 I4/mcm (140) ✔ 16 222 3 0.0 0.000 0.557 (0;000) ✗ 02/02/17
GePt ICSD 2624 Pmnb (62) ✔ 8 56 3 0.0 0.038 0.320 (0;000) ✗ 06/10/16
CdPt ICSD 102052 P4/mmm (123) ✔ 2 22 3 0.0 0.008 0.525 (1;110) ✗ 27/01/17
Ba2NaReO6 ICSD 200876 Fm-3m (225) ✔ 10 80 1 2.1561 2.227 0.000 (0;000) ✗ 05/01/17
NiBi3 ICSD 391336 Pnma (62) ✔ 16 220 3 0.0 0.002 0.716 (0;011) ✗ 02/02/17
HfGaCo ICSD 623085 P-62m (189) ✗ 9 102 3 0.0 0.000 0.782 ? ✗ 06/10/16
Sr5Bi3 ICSD 617154 P6_3/mcm (193) ✔ 16 190 1 0.0 0.000 0.580 (1;000) ✗ 02/02/17
Bi3Te2S ICSD 107587 P-3m1 (164) ✔ 12 126 2 0.0 0.083 0.030 (0;001) ✗ 02/02/17
Bi4RuBr2 ICSD 406951 C2/m (12) ✔ 14 180 2 0.3607 0.457 0.000 (0;000) ✗ 02/02/17
TaBi4ClO8 ICSD 59601 P4/mmm (123) ✔ 14 128 1 0.4995 1.233 0.000 (0;000) ✗ 02/02/17
SrBiBrO2 ICSD 97509 Cmcm (63) ✔ 10 88 1 2.8751 3.099 0.000 (0;000) ✗ 02/02/17
Ba2YNbO6 ICSD 172407 Fm-3m (225) ✔ 10 80 3 3.1567 3.157 0.000 (0;000) ✗ 05/01/17
GeBi4Te7 ICSD 42891 P-3m1 (164) ✔ 12 106 3 0.0 0.074 0.057 (1;001) ✗ 02/02/17
Bi4RuI2 ICSD 406949 I4/m (87) ✔ 14 180 2 0.3499 0.409 0.000 (0;000) ✗ 02/02/17
Bi4Te7Pb ICSD 42707 P-3m1 (164) ✔ 12 116 3 0.0 0.056 0.062 (1;001) ✗ 02/02/17
Ba2Ni3 ICSD 423734 P-3m1 (164) ✔ 5 50 2 0.0 0.000 0.618 (1;001) ✗ 05/01/17
SnBi4Te7 ICSD 236253 P-3m1 (164) ✔ 12 116 3 0.0129 0.135 0.000 (1;001) ✗ 02/02/17
NiO ICSD 246910 R-3m (166) ✔ 2 16 3 0.0 0.000 0.631 (0;000) ✔ 06/10/16
GeRh ICSD 44861 Pmnb (62) ✔ 8 84 3 0.0 0.005 0.264 (0;011) ✗ 06/10/16
ZrGaCo ICSD 623254 P-62m (189) ✗ 9 78 3 0.0 0.000 0.725 ? ✗ 06/10/16
Bi(TeBr2)2 ICSD 83806 P-1 (2) ✔ 14 110 3 1.0464 1.099 0.000 (0;000) ✗ 02/02/17