≤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
CaC2 COD 1010500 Pn-3m (224) ✔ 12 72 1 1.7564 2.259 0.000 (0;000) ✗ 27/01/17
CaCN2 COD 1010503 R-3m (166) ✔ 4 24 1 0.0 0.474 0.106 (0;000) ✗ 27/01/17
NaBrO3 COD 1010511 P2_13 (198) ✗ 20 136 1 2.1089 2.112 0.000 (0;000) ✗ 21/03/17
NaClO3 COD 1010512 P2_13 (198) ✗ 20 136 1 3.1663 3.168 0.000 (0;000) ✗ 22/03/17
NaClO3 COD 1010513 P2_13 (198) ✗ 20 136 1 1.9432 2.031 0.000 (0;000) ✗ 22/03/17
NO2 COD 1010516 I2_13 (199) ✗ 18 102 3 0.0 0.000 0.859 ? ✗ 29/03/17
GeS2 COD 1010520 Fdd2 (43) ✗ 18 96 3 2.2429 2.345 0.000 (0;000) ✗ 22/03/17
Na2SO4 COD 1010522 Cmcm (63) ✔ 14 96 1 5.0257 5.223 0.000 (0;000) ✗ 27/01/17
Na2SO3 COD 1010523 P-3 (147) ✔ 12 84 1 4.0495 4.171 0.000 (0;000) ✗ 27/01/17
ZnTe COD 1010535 Fm-3m (225) ✔ 2 18 3 0.0 0.000 0.283 (0;000) ✗ 27/01/17
CdTe COD 1010536 Fm-3m (225) ✔ 2 18 3 0.0 0.000 0.275 (1;000) ✗ 27/01/17
HgTe COD 1010537 Fm-3m (225) ✔ 2 18 3 0.0 0.000 0.386 (0;000) ✗ 27/01/17
SrH2 COD 1010560 Imma (74) ✔ 6 24 1 0.1164 0.543 0.000 (0;000) ✗ 27/01/17
KSbO3 COD 1010566 R-3 (148) ✔ 10 64 3 2.1217 2.300 0.000 (0;000) ✗ 27/01/17
KClO4 COD 1010568 F-43m (216) ✗ 6 40 1 1.6538 1.654 0.000 (0;000) ✗ 15/02/17
TlClO4 COD 1010570 F-43m (216) ✗ 6 44 1 1.3448 1.345 0.000 (0;000) ✗ 15/02/17
RbClO4 COD 1010571 F-43m (216) ✗ 6 40 1 1.1696 1.170 0.000 (0;000) ✗ 15/02/17
CsClO4 COD 1010572 F-43m (216) ✗ 6 40 1 0.533 0.533 0.000 (0;000) ✗ 15/02/17
NaClO4 COD 1010573 F-43m (216) ✗ 6 40 1 2.3653 2.366 0.000 (0;000) ✗ 15/02/17
AgClO4 COD 1010574 F-43m (216) ✗ 6 42 1 2.4263 2.431 0.000 (0;000) ✗ 15/02/17
CrCl3 COD 1010575 P3_212 (153) ✗ 24 210 2 0.0 0.002 0.594 ? ✗ 04/08/17
Ti2O3 COD 1010582 R-3c (167) ✔ 10 84 3 0.0 0.017 0.140 (0;000) ✗ 27/01/17
Ga2O3 COD 1010583 R-3c (167) ✔ 10 88 3 1.8896 1.890 0.000 (0;000) ✗ 27/01/17
Rh2O3 COD 1010584 R-3c (167) ✔ 10 104 3 0.0 0.034 0.291 (0;000) ✗ 27/01/17
BN COD 1010602 P-6m2 (187) ✗ 4 16 2 4.3937 4.522 0.000 (0;000) ✗ 15/02/17
Ag2O COD 1010604 Pn-3m (224) ✔ 6 56 3 0.0 0.003 0.004 (0;000) ✗ 05/01/17
Cs2GeF6 COD 1010607 Fm-3m (225) ✔ 9 64 1 6.5304 6.536 0.000 (0;000) ✗ 27/01/17
KClO4 COD 1010611 Pnma (62) ✔ 24 160 1 0.0 0.022 0.014 (0;000) ✗ 04/08/17
WO3 COD 1010618 P2_1/m (11) ✔ 16 184 3 0.0 0.005 0.532 (0;001) ✗ 11/04/17
HgCl2 COD 1010620 Pnma (62) ✔ 12 104 2 3.4224 3.429 0.000 (0;000) ✗ 02/02/17
BiI3 COD 1010622 P-3 (147) ✔ 24 216 2 0.947 0.947 0.000 (0;000) ✗ 04/08/17
NaIO2 COD 1010624 I4_1/amd (141) ✔ 8 56 3 0.0 0.021 0.110 (1;111) ✗ 30/01/17
K2SeBr6 COD 1010627 Fm-3m (225) ✔ 9 66 2 1.6082 1.983 0.000 (0;000) ✗ 02/02/17
K2Os(Cl2O)2 COD 1010629 I4/mmm (139) ✔ 9 74 1 0.7524 0.803 0.000 (0;000) ✗ 02/02/17
Al5C3N COD 1010635 P6_3mc (186) ✗ 18 64 3 0.176 1.164 0.000 (0;000) ✔ 26/04/17
Rb2PdBr6 COD 1010637 Fm-3m (225) ✔ 9 78 2 0.0222 0.153 0.000 (0;000) ✗ 02/02/17
GeS COD 1010649 Pnma (62) ✔ 8 40 1 0.0 0.219 0.103 (0;000) ✗ 27/01/17
NaLiCO3 COD 1010872 P-6m2 (187) ✗ 18 102 3 0.0 0.001 0.657 ? ✗ 15/02/17
TlSb COD 1010882 Pm-3m (221) ✔ 2 18 3 0.0 0.000 0.611 (0;000) ✗ 27/01/17
Rb2PdCl6 COD 1010889 Fm-3m (225) ✔ 9 78 1 0.9163 0.957 0.000 (0;000) ✗ 02/02/17
KSO4 COD 1010892 P-1 (2) ✔ 12 78 1 0.4677 0.523 0.000 (0;000) ✗ 27/01/17
SrCl2 COD 1010899 Fm-3m (225) ✔ 3 24 1 5.2948 5.509 0.000 (0;000) ✗ 27/01/17
CsIO3 COD 1010900 Pm-3m (221) ✔ 5 34 3 0.0 0.003 0.715 (0;000) ✗ 22/03/17
SrZrO3 COD 1010901 Pm-3m (221) ✔ 5 32 3 0.0 0.007 0.627 (0;000) ✗ 27/01/17
ZrO2 COD 1010912 P2_1/c (14) ✔ 12 64 3 2.3876 2.459 0.000 (0;000) ✗ 27/01/17
FeAsS COD 1010913 P2_1/c (14) ✔ 12 76 3 0.1573 0.372 0.000 (0;000) ✗ 05/01/17
BaCa(CO3)2 COD 1010917 P2_1 (4) ✗ 20 128 2 2.6308 2.662 0.000 (0;000) ✗ 21/03/17
YAsO4 COD 1010919 I4_1/amd (141) ✔ 12 80 3 3.2433 3.280 0.000 (0;000) ✗ 05/01/17
CuS COD 1010920 P6_3/mmc (194) ✔ 12 102 3 0.0 0.000 0.845 (0;000) ✗ 02/02/17
SiO2 COD 1010921 P2_13 (198) ✗ 24 128 3 4.1689 4.182 0.000 (0;000) ✗ 04/08/17
Fe3C COD 1010931 Pnma (62) ✔ 16 112 3 0.0 0.001 0.476 (1;000) ✗ 27/01/17
CaCrO4 COD 1010939 I4_1/amd (141) ✔ 12 96 1 2.8326 2.833 0.000 (0;000) ✗ 27/01/17
Co2CuS4 COD 1010946 Fd-3m (227) ✔ 14 138 3 0.0 0.000 0.789 (0;000) ✗ 02/02/17
Cu3As COD 1010982 P-3c1 (165) ✔ 24 228 3 0.0 0.013 0.387 (0;000) ✗ 04/08/17
K3Na(SO4)2 COD 1011019 P-3m1 (164) ✔ 14 96 1 0.0 0.003 0.251 (0;000) ✗ 02/02/17
H2O COD 1011024 Ibam (72) ✔ 24 64 2 0.0 0.002 0.187 (0;000) ✗ 04/08/17
AlHO2 COD 1011027 Pnma (62) ✔ 16 64 3 3.8534 3.853 0.000 (0;000) ✗ 05/01/17
NiS COD 1011038 R3m (160) ✗ 6 48 3 0.0 0.000 0.430 ? ✗ 15/02/17
NaAlAsO4F COD 1011040 C2/c (15) ✔ 16 96 3 4.1684 4.168 0.000 (0;000) ✗ 05/01/17
PbClF COD 1011046 P4/nmm (129) ✔ 6 56 2 3.1252 3.139 0.000 (0;000) ✗ 27/01/17
NiAs COD 1011052 P6_3/mmc (194) ✔ 4 30 3 0.0 0.000 0.767 (1;000) ✗ 05/01/17
Co3S4 COD 1011056 Fd-3m (227) ✔ 14 150 3 0.0 0.000 0.360 (0;000) ✗ 02/02/17
CaMg(SiO3)2 COD 1011057 C2/c (15) ✔ 20 128 3 5.0012 5.001 0.000 (0;000) ✗ 02/02/17
PbClF COD 1011058 P4/nmm (129) ✔ 6 56 1 1.7485 1.842 0.000 (0;000) ✗ 27/01/17
HgBr COD 1011061 I4/mmm (139) ✔ 4 38 1 2.4091 2.524 0.000 (0;000) ✗ 02/02/17
H2O COD 1011063 C222_1 (20) ✗ 12 32 3 3.802 4.116 0.000 (0;000) ✗ 15/02/17
NaNbO3 COD 1011064 Pm-3m (221) ✔ 5 40 3 1.7183 2.402 0.000 (0;000) ✗ 27/01/17
V2O3 COD 1011066 R-3c (167) ✔ 10 88 3 0.0 0.000 0.536 (1;000) ✗ 27/01/17
Cr2O3 COD 1011067 R-3c (167) ✔ 10 92 3 0.0 0.020 0.757 (1;000) ✗ 27/01/17
Te2Au COD 1011091 Pma2 (28) ✗ 24 184 3 0.0 0.002 0.593 ? ✗ 04/08/17
Te COD 1011098 P3_121 (152) ✗ 3 18 3 0.0 0.000 0.016 (0;000) ✔ 15/02/17
TaSbO4 COD 1011144 Pnna (52) ✔ 24 168 3 0.0 0.009 1.000 (1;000) ✗ 04/08/17
BaCO3 COD 1011149 Pnma (62) ✔ 20 128 2 4.4216 4.463 0.000 (0;000) ✗ 02/02/17
FeCu2SnS4 COD 1011151 I-42m (121) ✗ 8 68 3 0.0 0.001 0.361 (1;111) ✔ 15/02/17
Na6S2ClO8F COD 1011182 Fm-3m (225) ✔ 18 128 1 4.6318 4.636 0.000 (0;000) ✗ 02/02/17
TeO2 COD 1011183 Pbca (61) ✔ 24 144 2 0.1166 0.231 0.000 (0;000) ✗ 04/08/17
Na2SO4 COD 1011184 Fddd (70) ✔ 14 96 1 5.2961 5.316 0.000 (0;000) ✗ 27/01/17
FeO COD 1011198 Fm-3m (225) ✔ 2 14 3 0.0 0.073 0.319 (0;000) ✗ 27/01/17
CaTiO3 COD 1011211 Pm-3m (221) ✔ 5 40 3 2.033 2.432 0.000 (0;000) ✗ 27/01/17
Fe3N COD 1011217 P6_322 (182) ✗ 8 58 3 0.0 0.000 0.743 ? ✗ 15/02/17
CaTiSiO5 COD 1011220 C2/c (15) ✔ 16 112 3 3.1981 3.228 0.000 (0;000) ✗ 27/01/17
V2O5 COD 1011225 Pmn2_1 (31) ✗ 14 112 2 1.4532 1.614 0.000 (0;000) ✗ 15/02/17
MnCO3 COD 1011228 R-3c (167) ✔ 10 74 3 0.0 0.000 0.716 (0;000) ✗ 27/01/17
CoAs3 COD 1011231 Im3 (204) ✔ 16 128 3 0.0 0.000 0.101 (1;000) ✗ 30/01/17
KAl(SO4)2 COD 1011235 P321 (150) ✗ 12 72 2 1.6616 1.732 0.000 (0;000) ✗ 15/02/17
Mg(FeO2)2 COD 1011245 Fd-3m (227) ✔ 14 100 3 0.0 0.006 0.342 (0;000) ✗ 27/01/17
Fe2O3 COD 1011267 R-3c (167) ✔ 10 68 3 0.0 0.040 0.793 (1;000) ✗ 27/01/17
Mg3P2 COD 1011277 Pn-3m (224) ✔ 10 80 1 1.0541 1.179 0.000 (0;000) ✗ 02/02/17
AgSbO3 COD 1011279 Fd-3m (227) ✔ 20 136 3 0.0 0.000 0.357 (0;000) ✗ 30/01/17
YF3 COD 1011296 Pm-3m (221) ✔ 12 96 3 4.7827 4.951 0.000 (0;000) ✗ 27/01/17
Fe2As COD 1011298 P4/nmm (129) ✔ 6 42 3 0.0 0.000 0.749 (1;001) ✗ 05/01/17
V3Si COD 1011299 Pm-3n (223) ✔ 8 86 3 0.0 0.000 0.901 (1;000) ✗ 27/01/17
CaB6 COD 1011310 Pm-3m (221) ✔ 7 28 3 0.1914 0.191 0.000 (0;000) ✗ 05/01/17
K2OsCl6 COD 1011311 Fm-3m (225) ✔ 9 76 2 0.0 0.439 0.108 (0;000) ✗ 02/02/17
K2OsBr6 COD 1011312 Fm-3m (225) ✔ 9 76 2 0.0 0.441 0.133 (0;000) ✗ 02/02/17
RbCl COD 1011313 Pm-3m (221) ✔ 2 16 1 5.7453 5.753 0.000 (0;000) ✗ 27/01/17
LiCl COD 1011314 Fm-3m (225) ✔ 2 10 1 6.2774 6.277 0.000 (0;000) ✗ 27/01/17
BeO COD 1011325 Fm-3m (225) ✔ 2 10 1 6.5102 6.607 0.000 (0;000) ✗ 05/01/17
PdO COD 1011329 P4/mmm (123) ✔ 2 24 2 0.0 0.009 0.422 (0;110) ✗ 27/01/17
PbI2 COD 1011333 P-3m1 (164) ✔ 3 28 2 1.1015 2.099 0.000 (0;000) ✗ 30/01/17