≤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
Cs2P3 ICSD 65185 Fmmm (69) ✔ 10 66 1 0.8432 0.843 0.000 (0;000) ✗ 02/02/17
Cs2TeBr6 ICSD 65058 Fm-3m (225) ✔ 9 66 2 1.8801 2.124 0.000 (0;000) ✗ 02/02/17
Zr2Al3C4 ICSD 159411 P6_3/mmc (194) ✔ 18 66 3 0.0 0.000 0.988 (1;000) ✗ 02/02/17
Rb2P3 ICSD 654296 Fmmm (69) ✔ 10 66 1 0.7411 0.741 0.000 (0;000) ✗ 02/02/17
YMnNi4 ICSD 643173 F-43m (216) ✗ 6 66 3 0.0 0.000 0.568 ? ✗ 15/02/17
CsHg2 ICSD 408695 Imma (74) ✔ 6 66 3 0.0 0.000 0.434 (0;011) ✗ 02/02/17
H2C5SN COD 7200215 P-1 (2) ✔ 18 66 1 1.9486 2.273 0.000 (0;000) ✗ 02/02/17
HfI3 ICSD 23947 P6_3/mcm (193) ✔ 8 66 1 0.0 0.000 0.633 (0;000) ✗ 02/02/17
TaI2O COD 2004011 C2/m (12) ✔ 8 66 2 0.7657 0.861 0.000 (0;000) ✗ 02/02/17
TiF3 ICSD 67148 R-3c (167) ✔ 8 66 3 0.0 0.000 0.753 (0;000) ✗ 22/03/17
H5(C2O)2 COD 4113700 P-1 (2) ✔ 22 66 1 2.6956 2.724 0.000 (0;000) ✗ 04/08/17
BH2S3N3F4 ICSD 201705 P1 (1) ✗ 13 66 1 2.3977 2.402 0.000 (0;000) ✗ 21/03/17
K2TeCl6 COD 1010188 I4/mmm (139) ✔ 9 66 1 2.3605 2.621 0.000 (0;000) ✗ 02/02/17
Hf2Al3 ICSD 608101 Fdd2 (43) ✗ 10 66 3 0.0 0.000 0.865 ? ✗ 15/02/17
MgPSe3 ICSD 642731 R-3 (148) ✔ 10 66 2 2.0858 2.086 0.000 (0;000) ✗ 02/02/17
Zr5Al3C ICSD 606294 P6_3/mcm (193) ✔ 18 66 3 0.0 0.000 0.866 (1;000) ✗ 02/02/17
MgPS3 ICSD 642729 C2/m (12) ✔ 10 66 2 2.4505 2.456 0.000 (0;000) ✗ 02/02/17
NiPSe3 ICSD 646145 C2/m (12) ✔ 10 66 2 0.0 0.021 0.226 (0;000) ✗ 02/02/17
K2TeBr6 ICSD 65118 Fm-3m (225) ✔ 9 66 2 1.952 2.209 0.000 (0;000) ✗ 02/02/17
Cs2SeCl6 COD 1010222 Fm-3m (225) ✔ 9 66 1 2.598 2.786 0.000 (0;000) ✗ 02/02/17
Cs2TeCl6 COD 1010233 Fm-3m (225) ✔ 9 66 1 2.604 2.793 0.000 (0;000) ✗ 02/02/17
Li8Pb3 COD 1528240 R-3m (166) ✔ 11 66 1 0.0 0.158 0.632 (1;111) ✗ 02/02/17
PH8C4N3O4 COD 2221677 P1 (1) ✗ 20 68 1 2.9893 3.073 0.000 (0;000) ✗ 15/02/17
Zr3Sb ICSD 651786 I-4 (82) ✗ 16 68 3 0.0 0.010 0.462 ? ✗ 29/03/17
NaGaTe2 ICSD 44702 I4/mcm (140) ✔ 8 68 1 0.1829 0.394 0.000 (0;000) ✗ 02/02/17
SrSi6 ICSD 240779 Cmcm (63) ✔ 14 68 3 0.0 0.003 0.928 (0;110) ✗ 02/02/17
BaCdSbF ICSD 421815 P4/nmm (129) ✔ 8 68 1 0.0848 0.085 0.000 (0;000) ✗ 02/02/17
MgCu4Sn COD 1525035 F-43m (216) ✗ 6 68 3 0.0 0.104 0.259 (0;000) ✔ 15/02/17
FeAg2SnS4 COD 1008963 I-42m (121) ✗ 8 68 3 0.0 0.010 0.290 (1;111) ✔ 16/03/17
YZnPO ICSD 418523 R-3m (166) ✔ 8 68 3 1.278 1.369 0.000 (0;000) ✗ 29/03/17
KInTe2 COD 2001367 I4/mcm (140) ✔ 8 68 1 0.9234 1.267 0.000 (0;000) ✗ 02/02/17
SrSbSe2F ICSD 171430 P4/nmm (129) ✔ 10 68 1 0.0 0.024 0.007 (0;000) ✗ 02/02/17
AlBW COD 4343329 Cmcm (63) ✔ 6 68 3 0.0 0.097 0.225 (1;110) ✗ 11/04/17
FeCu2SnS4 COD 1011151 I-42m (121) ✗ 8 68 3 0.0 0.001 0.361 (1;111) ✔ 15/02/17
FeCu2SnSe4 ICSD 169839 I-42m (121) ✗ 8 68 3 0.0 0.004 0.448 ? ✗ 15/02/17
BaReH9 ICSD 75460 P6_3/mmc (194) ✔ 22 68 1 2.9946 2.995 0.000 (0;000) ✗ 04/08/17
BaAl2Sb2O7 ICSD 154362 R32 (155) ✗ 12 68 2 3.3911 3.600 0.000 (0;000) ✗ 16/03/17
ScInCu4 ICSD 416528 F-43m (216) ✗ 6 68 3 0.0 0.413 0.159 (0;000) ✔ 15/03/17
H2C2I COD 4508289 P-1 (2) ✔ 20 68 1 2.6863 2.762 0.000 (0;000) ✗ 02/02/17
Li4H6Os ICSD 638269 R-3c (167) ✔ 22 68 1 2.3096 2.310 0.000 (0;000) ✗ 04/08/17
Rb2SnHgTe4 ICSD 262390 I-42m (121) ✗ 8 68 1 0.3755 0.886 0.000 (0;000) ✔ 29/03/17
BW COD 9008954 I4_1/amd (141) ✔ 8 68 3 0.0 0.008 1.000 (1;111) ✗ 21/03/17
Pt(NCl)2 COD 9014307 P4/m (83) ✔ 10 68 3 0.0 0.009 0.422 (1;000) ✗ 02/02/17
Cs2Zr(AgTe2)2 ICSD 80195 C222 (21) ✗ 9 68 2 1.2649 1.606 0.000 (0;000) ✗ 16/03/17
S3N2O COD 7005890 Cc (9) ✗ 12 68 1 2.1634 2.250 0.000 (0;000) ✗ 29/03/17
LiH5C5N2O5 COD 2200233 P1 (1) ✗ 18 68 1 2.9567 3.022 0.000 (0;000) ✗ 15/02/17
BaGe6 COD 4341768 Cmcm (63) ✔ 14 68 3 0.0 0.005 0.938 (0;110) ✗ 02/02/17
H3C2O COD 2216740 P-1 (2) ✔ 24 68 2 3.2998 3.326 0.000 (0;000) ✗ 04/08/17
RbGeCl3 COD 7221358 P2_1/m (11) ✔ 10 68 1 3.6922 3.704 0.000 (0;000) ✗ 02/02/17
HfSb ICSD 638877 P2_13 (198) ✗ 8 68 3 0.0 0.000 0.734 ? ✗ 15/02/17
LiGaAs2O7 ICSD 161500 C2 (5) ✗ 11 68 3 3.2297 3.364 0.000 (0;000) ✗ 15/02/17
Bi2Te4Pb ICSD 616936 R-3m (166) ✔ 7 68 3 0.0449 0.134 0.000 (1;111) ✗ 02/02/17
Na2CdSnS4 COD 7011307 C2 (5) ✗ 8 68 3 2.0139 2.014 0.000 (0;000) ✗ 22/03/17
NaInTe2 ICSD 25346 I4/mcm (140) ✔ 8 68 1 0.7113 0.926 0.000 (0;000) ✗ 02/02/17
K2SnHgSe4 ICSD 413308 I-42m (121) ✗ 8 68 1 1.5248 1.525 0.000 (0;000) ✗ 29/03/17
BaSi6 COD 8103027 Cmcm (63) ✔ 14 68 3 0.0 0.004 0.931 (0;110) ✗ 02/02/17
H10C7O5 COD 7218172 P1 (1) ✗ 22 68 1 4.6528 4.703 0.000 (0;000) ✗ 04/08/17
FeCu2SnS4 ICSD 181166 P-42m (111) ✗ 8 68 3 0.0 0.005 0.465 ? ✗ 15/02/17
K2CuSb ICSD 53298 Cmcm (63) ✔ 8 68 1 1.0717 1.239 0.000 (0;000) ✗ 02/02/17
H3I3N2 ICSD 27416 P2_1/m (11) ✔ 16 68 3 0.8803 1.057 0.000 (0;000) ✗ 02/02/17
Co(IN2)3 COD 9015112 Fm-3m (225) ✔ 10 68 1 0.0 0.033 0.289 (1;000) ✗ 02/02/17
CrB ICSD 613476 I4_1/amd (141) ✔ 8 68 3 0.0 0.005 0.669 (1;111) ✗ 21/03/17
CsGaS2 COD 1529692 C2/c (15) ✔ 8 68 1 3.367 3.379 0.000 (0;000) ✗ 02/02/17
NbI3 ICSD 109145 P6_3/mcm (193) ✔ 8 68 1 0.0 0.006 0.336 (0;000) ✗ 02/02/17
K2CuP ICSD 61082 Cmcm (63) ✔ 8 68 1 1.118 1.194 0.000 (0;000) ✗ 22/03/17
K2CdSnSe4 ICSD 185468 I-42m (121) ✗ 8 68 1 1.761 1.761 0.000 (0;000) ✗ 22/03/17
BaSbClO2 ICSD 200962 Cmcm (63) ✔ 10 68 1 0.8819 2.937 1.000 (0;000) ✗ 02/02/17
YInCu4 ICSD 628179 F-43m (216) ✗ 6 68 3 0.0 0.502 0.123 (0;000) ✔ 15/02/17
Li4RuH6 ICSD 638272 R-3c (167) ✔ 22 68 1 2.2498 2.250 0.000 (0;000) ✗ 04/08/17
H3AuC2NCl ICSD 152108 P2_1 (4) ✗ 16 68 1 3.3571 3.585 0.000 (0;000) ✗ 21/03/17
FeCu2SnS4 COD 9004745 I-42m (121) ✗ 8 68 3 0.0 0.004 0.365 (1;111) ✔ 15/02/17
SiPt3 ICSD 649613 P4/mbm (127) ✔ 8 68 3 0.0 0.019 0.278 (1;000) ✗ 02/02/17
H3C4N3 COD 2205937 Pc (7) ✗ 20 68 1 4.3703 4.482 0.000 (0;000) ✗ 21/03/17
Ge4Te7As2 ICSD 68114 R-3m (166) ✔ 13 68 2 0.0 0.020 0.022 (1;000) ✗ 21/03/17
CaZnSO ICSD 245309 P6_3mc (186) ✗ 8 68 1 2.7339 2.734 0.000 (0;000) ✗ 15/02/17
CuH6BrN2 COD 7104068 C2/c (15) ✔ 20 68 1 2.3525 2.353 0.000 (0;000) ✗ 02/02/17
RbInTe2 ICSD 75346 I4/mcm (140) ✔ 8 68 1 0.9151 1.411 0.000 (0;000) ✗ 02/02/17
Pd(Se3Br)2 ICSD 418160 P-1 (2) ✔ 9 68 2 0.7959 0.796 0.000 (0;000) ✗ 02/02/17
HCO2 COD 5900034 P2_1/c (14) ✔ 16 68 1 0.0 0.011 0.058 (1;010) ✗ 02/02/17
H3C2O COD 2005623 Fdd2 (43) ✗ 24 68 2 4.9086 5.077 0.000 (0;000) ✗ 04/08/17
Na2Zr(CuS2)2 ICSD 79536 C2/m (12) ✔ 9 68 1 0.0 0.012 0.006 (1;000) ✗ 27/01/17
YAgTe2 ICSD 154792 P-42_1m (113) ✗ 8 68 3 0.6696 0.692 0.000 (0;000) ✗ 07/10/16
KClO3 COD 1010217 P2_1/m (11) ✔ 10 68 1 1.326 1.347 0.000 (0;000) ✗ 27/01/17
InPPt5 ICSD 640194 P4/mmm (123) ✔ 7 68 3 0.0 0.007 0.517 (1;000) ✗ 27/01/17
VF3 COD 1000468 R-3c (167) ✔ 8 68 3 0.0 0.014 0.628 (0;000) ✗ 27/01/17
SrCd2 COD 1524728 Imma (74) ✔ 6 68 3 0.0 0.012 0.472 (0;111) ✗ 27/01/17
K2AgP COD 8103396 Cmcm (63) ✔ 8 68 1 1.1954 1.279 0.000 (0;000) ✗ 30/01/17
CsAgBr2 COD 1509157 Cmcm (63) ✔ 8 68 2 2.0615 2.492 0.000 (0;000) ✗ 30/01/17
CrCdF6 COD 1525283 R-3 (148) ✔ 8 68 3 0.0 0.029 0.188 (0;000) ✗ 27/01/17
Na2AgSb COD 7209348 Cmcm (63) ✔ 8 68 1 0.5506 0.615 0.000 (0;000) ✗ 30/01/17
ZnCO3 COD 9000099 R-3c (167) ✔ 10 68 3 3.7274 4.675 0.000 (0;000) ✗ 27/01/17
MoP4 ICSD 105057 C2/c (15) ✔ 10 68 2 0.0 0.019 0.126 (1;000) ✔ 04/10/16
TiP COD 9008969 P6_3/mmc (194) ✔ 8 68 3 0.0 0.003 0.549 (1;000) ✗ 27/01/17
ZrGa COD 1522708 I4_1/amd (141) ✔ 8 68 3 0.0 0.004 0.747 (1;111) ✗ 27/01/17
NiMoP2 ICSD 76283 P6_3/mmc (194) ✔ 8 68 3 0.0 0.016 0.293 (0;000) ✗ 27/01/17
HCO2 COD 4507991 P2_1/c (14) ✔ 16 68 1 3.2517 3.449 0.000 (0;000) ✗ 27/01/17
K2AgBi ICSD 1156 C222_1 (20) ✗ 8 68 1 0.6946 0.866 0.000 (0;000) ✗ 06/10/16
CsAgBr2 ICSD 150302 P4/nmm (129) ✔ 8 68 2 1.7855 2.190 0.000 (0;000) ✗ 30/01/17
MgMoN2 COD 7208132 P6_3/mmc (194) ✔ 8 68 3 0.0 1.535 0.119 (0;000) ✗ 27/01/17
MoP4 COD 2106092 C2/c (15) ✔ 10 68 2 0.0 0.019 0.126 (1;000) ✗ 27/01/17