≤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
AsCl3O ICSD 411196 P2_1/c (14) ✔ 20 128 1 2.8211 2.897 0.000 (0;000) ✗ 30/01/17
TlF COD 1520823 Pbcm (57) ✔ 8 80 2 2.8245 2.913 0.000 (0;000) ✗ 27/01/17
TlF ICSD 90992 Pmab (57) ✔ 8 80 2 2.8245 2.913 0.000 (0;000) ✗ 06/10/16
Na4CO4 ICSD 245415 R3 (146) ✗ 9 64 3 2.8246 3.273 0.000 (0;000) ✗ 06/10/16
CsHg5Cl11 ICSD 39767 C2/m (12) ✔ 17 146 3 2.8247 2.946 0.000 (0;000) ✗ 02/02/17
NO2 COD 2104473 Im3 (204) ✔ 18 102 1 2.8252 2.825 0.000 (0;000) ✗ 02/02/17
SnPCl9 ICSD 60093 P-1 (2) ✔ 22 164 1 2.8264 2.826 0.000 (0;000) ✗ 04/08/17
CaSnO3 ICSD 56095 Pm-3m (221) ✔ 5 42 3 2.8282 3.851 0.000 (0;000) ✗ 27/01/17
Ba3InS4Cl ICSD 427796 I4/mcm (140) ✔ 18 148 1 2.8306 2.941 0.000 (0;000) ✗ 02/02/17
CaCrO4 COD 1010939 I4_1/amd (141) ✔ 12 96 1 2.8326 2.833 0.000 (0;000) ✗ 27/01/17
TlHg5Cl11 COD 7221334 C2/m (12) ✔ 17 150 3 2.8327 3.194 0.000 (0;000) ✗ 02/02/17
MgPbF6 COD 1527518 R-3 (148) ✔ 8 66 3 2.8342 2.880 0.000 (0;000) ✗ 27/01/17
Rb3AlO3 ICSD 74969 C2/m (12) ✔ 14 96 3 2.8352 2.835 0.000 (0;000) ✗ 30/01/17
CsC ICSD 51534 Pnma (62) ✔ 16 104 1 2.8353 2.840 0.000 (0;000) ✗ 02/02/17
PbSO3 COD 9009622 P2_1/m (11) ✔ 10 76 3 2.8374 2.837 0.000 (0;000) ✗ 27/01/17
Li2Se COD 9009061 Fm-3m (225) ✔ 3 12 1 2.8431 3.253 0.000 (0;000) ✗ 27/01/17
CaZrO3 COD 5910140 Pm-3m (221) ✔ 5 32 3 2.8438 2.844 0.000 (0;000) ✗ 27/01/17
AlGaN2 ICSD 187055 P-4m2 (115) ✗ 4 26 3 2.845 2.845 0.000 (0;000) ✗ 06/10/16
NaLi2N COD 1526562 Fm-3m (225) ✔ 4 20 1 2.8455 2.846 0.000 (0;000) ✗ 27/01/17
Hf(MoO4)2 COD 1532569 C2/c (15) ✔ 22 176 3 2.8462 2.846 0.000 (0;000) ✗ 07/08/17
BaTeO3 COD 1524714 P2_1/m (11) ✔ 10 68 1 2.8465 2.873 0.000 (0;000) ✗ 05/01/17
Li2H6PtO6 ICSD 251041 P-3 (147) ✔ 15 58 1 2.847 2.876 0.000 (0;000) ✗ 27/01/17
Ba2CaWO6 ICSD 76436 Fm-3m (225) ✔ 10 80 1 2.8479 2.918 0.000 (0;000) ✗ 05/01/17
CsNO2 ICSD 50328 P3_121 (152) ✗ 12 78 1 2.8488 3.021 0.000 (0;000) ✗ 28/10/16
CsAs3O8 COD 2102799 C2/c (15) ✔ 24 144 3 2.8495 2.850 0.000 (0;000) ✗ 04/08/17
H4NClO2 COD 2205376 P-42_1m (113) ✗ 16 56 1 2.8507 2.901 0.000 (0;000) ✗ 15/02/17
Rb4CO4 ICSD 245437 R3 (146) ✗ 9 64 3 2.8509 2.870 0.000 (0;000) ✗ 06/10/16
Na2ZnGeO4 COD 2008958 Pc (7) ✗ 16 116 3 2.8509 3.032 0.000 (0;000) ✗ 22/03/17
CsBrF4 ICSD 426292 Immm (71) ✔ 12 88 1 2.8511 2.867 0.000 (0;000) ✗ 02/02/17
RbLiS ICSD 67254 P4/nmm (129) ✔ 6 36 1 2.8523 2.922 0.000 (0;000) ✗ 27/01/17
K3AlO3 ICSD 166540 C2/m (12) ✔ 14 96 1 2.8531 2.861 0.000 (0;000) ✗ 30/01/17
CaPtF6 ICSD 37443 R-3 (148) ✔ 8 62 1 2.8543 2.877 0.000 (0;000) ✗ 27/01/17
NaInBr4 ICSD 65462 P2_12_12_1 (19) ✗ 24 200 1 2.8544 2.854 0.000 (0;000) ✗ 04/08/17
Na2H6PtO6 ICSD 251042 P-3 (147) ✔ 15 70 1 2.8576 2.890 0.000 (0;000) ✗ 27/01/17
H4INO4 COD 2008618 I4_1/a (88) ✔ 20 80 1 2.8578 2.859 0.000 (0;000) ✗ 02/02/17
CdBiClO2 COD 2012362 P2_1/m (11) ✔ 10 92 3 2.8582 3.016 0.000 (0;000) ✗ 05/01/17
Sr2MgTeO6 ICSD 290893 C2/m (12) ✔ 10 72 3 2.8585 2.859 0.000 (0;000) ✗ 27/01/17
Ga2O3 ICSD 27431 R-3c (167) ✔ 10 88 3 2.8601 3.106 0.000 (0;000) ✗ 27/01/17
MgSn(BO3)2 ICSD 28266 R-3 (148) ✔ 10 66 3 2.8625 2.973 0.000 (0;000) ✗ 05/01/17
AsBr3 COD 1010147 P2_12_12_1 (19) ✗ 16 104 1 2.8654 2.924 0.000 (0;000) ✗ 21/03/17
SN ICSD 37353 P2_1/c (14) ✔ 8 44 1 2.8674 3.081 0.000 (0;000) ✗ 27/01/17
SbBr3 ICSD 27405 Pnma (62) ✔ 16 104 1 2.8677 2.983 0.000 (0;000) ✗ 02/02/17
SrGa4O7 COD 2002229 C2/c (15) ✔ 24 208 3 2.8686 2.869 0.000 (0;000) ✗ 04/08/17
RbCdBr3 ICSD 808 Pnma (62) ✔ 20 168 1 2.8691 2.929 0.000 (0;000) ✗ 02/02/17
CsRbC2 ICSD 189823 Pnma (62) ✔ 16 104 1 2.8694 3.018 0.000 (0;000) ✗ 02/02/17
Rb2SiS3 COD 8100236 C2/m (12) ✔ 12 80 1 2.8708 2.943 0.000 (0;000) ✗ 02/02/17
KInBr4 COD 1004072 Pnna (52) ✔ 24 200 1 2.8711 2.871 0.000 (0;000) ✗ 04/08/17
BiClF8 ICSD 39555 P-1 (2) ✔ 20 156 1 2.8713 2.871 0.000 (0;000) ✗ 02/02/17
K2CdN12 ICSD 659621 C2/m (12) ✔ 15 90 3 2.8735 2.989 0.000 (0;000) ✗ 02/02/17
NaVO3 COD 9011241 Pnma (62) ✔ 20 160 1 2.8739 2.938 0.000 (0;000) ✗ 02/02/17
MgC2 ICSD 88057 P4_2/mnm (136) ✔ 6 36 2 2.874 3.338 0.000 (0;000) ✗ 27/01/17
Rb2Cr2O7 COD 1527737 C2/c (15) ✔ 22 176 1 2.8743 2.900 0.000 (0;000) ✗ 07/08/17
SrBiBrO2 ICSD 97509 Cmcm (63) ✔ 10 88 1 2.8751 3.099 0.000 (0;000) ✗ 02/02/17
BiF3 ICSD 25567 P-43m (215) ✗ 16 104 3 2.8752 2.876 0.000 (0;000) ✗ 06/10/16
Rb2ZnI4 ICSD 56425 P2_1/m (11) ✔ 14 116 1 2.8761 2.876 0.000 (0;000) ✗ 02/02/17
Y2C(NO)2 ICSD 245333 P6_3/mmc (194) ✔ 14 96 3 2.8762 3.111 0.000 (0;000) ✗ 27/01/17
Sr2Nb2O7 COD 2106522 Cmc2_1 (36) ✗ 22 176 2 2.8766 3.077 0.000 (0;000) ✗ 07/08/17
K3Sb2N2O6F7 ICSD 200740 C2/m (12) ✔ 20 132 1 2.8769 2.886 0.000 (0;000) ✗ 02/02/17
K4CO4 ICSD 245417 P-43m (215) ✗ 9 64 3 2.878 2.878 0.000 (0;000) ✗ 06/10/16
Ba2ZnO3 COD 2002534 C2/c (15) ✔ 24 200 2 2.883 2.885 0.000 (0;000) ✗ 04/08/17
Rb2W2O7 ICSD 300230 P2_1/c (14) ✔ 22 232 2 2.8846 3.271 0.000 (0;000) ✗ 08/08/17
Sr2CaWO6 ICSD 36459 Fm-3m (225) ✔ 10 80 1 2.8848 2.957 0.000 (0;000) ✗ 27/01/17
Al2CdS4 ICSD 83526 I-4 (82) ✗ 7 42 3 2.885 2.993 0.000 (0;000) ✗ 06/10/16
V2Zn2O7 ICSD 250002 C2/m (12) ✔ 11 92 3 2.8851 3.204 0.000 (0;000) ✗ 27/01/17
SiO2 ICSD 155252 P3_221 (154) ✗ 9 48 1 2.8856 3.133 0.000 (0;000) ✗ 15/02/17
Sr2SnO4 ICSD 150388 I4/mmm (139) ✔ 7 58 2 2.8857 3.258 0.000 (0;000) ✗ 27/01/17
Zn2SiO4 COD 9007526 I-42d (122) ✗ 14 104 3 2.8884 2.888 0.000 (0;000) ✗ 15/02/17
K4CO4 ICSD 245424 Cm (8) ✗ 9 64 3 2.8885 2.927 0.000 (0;000) ✗ 06/10/16
CSCl2 ICSD 300291 P2_1/c (14) ✔ 16 96 1 2.8885 2.901 0.000 (0;000) ✗ 02/02/17
RbCN5O2 COD 7004730 Cc (9) ✗ 18 100 1 2.8893 2.908 0.000 (0;000) ✗ 22/03/17
Ge2N2O ICSD 200844 Cmc2_1 (36) ✗ 10 48 3 2.8949 3.231 0.000 (0;000) ✗ 06/10/16
TlCdCl3 ICSD 39807 Pnma (62) ✔ 20 184 2 2.8952 2.896 0.000 (0;000) ✗ 02/02/17
CdH6C2I2(NO)2 ICSD 192774 P-1 (2) ✔ 15 62 1 2.8954 2.929 0.000 (0;000) ✗ 02/02/17
KIO3 COD 1530118 P1 (1) ✗ 20 136 1 2.8982 2.899 0.000 (0;000) ✗ 29/03/17
BaH2 ICSD 615909 Pnma (62) ✔ 12 48 1 2.9001 3.374 0.000 (0;000) ✗ 02/02/17
K2PtF6 COD 1528732 P-3m1 (164) ✔ 9 70 1 2.9011 2.908 0.000 (0;000) ✗ 27/01/17
H3(C3F)2 COD 4102744 P-1 (2) ✔ 22 82 2 2.9015 2.911 0.000 (0;000) ✗ 04/08/17
Li6Br3N COD 1528848 Fm-3m (225) ✔ 10 44 1 2.9029 3.244 0.000 (0;000) ✗ 27/01/17
SnF2 COD 1527293 P2_12_12_1 (19) ✗ 12 112 3 2.9033 3.278 0.000 (0;000) ✗ 22/03/17
CoSnC4Cl3O4 ICSD 69685 R3 (146) ✗ 13 92 1 2.9036 2.918 0.000 (0;000) ✗ 21/03/17
CaGe2O5 COD 8103645 P-1 (2) ✔ 16 96 3 2.9045 2.938 0.000 (0;000) ✗ 27/01/17
Sr2ZnWO6 ICSD 190595 P2_1/c (14) ✔ 20 164 3 2.9052 3.041 0.000 (0;000) ✗ 02/02/17
Ge2N2O ICSD 200842 Cmc2_1 (36) ✗ 10 48 3 2.9053 3.235 0.000 (0;000) ✗ 06/10/16
Cs2Zn3S4 ICSD 627093 Ibam (72) ✔ 18 156 2 2.9058 2.906 0.000 (0;000) ✗ 22/03/17
TaBiO4 COD 1532721 Pnna (52) ✔ 24 208 3 2.9069 2.907 0.000 (0;000) ✗ 04/08/17
Rb2AgCl3 COD 2008760 Pnma (62) ✔ 24 200 1 2.9077 2.908 0.000 (0;000) ✗ 04/08/17
K4CO4 ICSD 245426 Cm (8) ✗ 9 64 3 2.9078 3.076 0.000 (0;000) ✗ 06/10/16
Ge2N2O ICSD 200845 Cmc2_1 (36) ✗ 10 48 3 2.9087 3.213 0.000 (0;000) ✗ 06/10/16
BiF3 ICSD 24522 Fm-3m (225) ✔ 4 26 3 2.9096 3.077 0.000 (0;000) ✗ 06/10/16
Zr(MoO4)2 ICSD 420668 C2/c (15) ✔ 22 160 3 2.9098 2.989 0.000 (0;000) ✗ 07/08/17
Tl2SnCl6 COD 1010177 Fm-3m (225) ✔ 9 82 1 2.9112 2.911 0.000 (0;000) ✗ 02/02/17
KNbF6 COD 2310528 P-4c2 (116) ✗ 16 128 3 2.9122 2.918 0.000 (0;000) ✗ 22/03/17
PbBrCl ICSD 45881 Pnma (62) ✔ 12 112 2 2.9126 3.004 0.000 (0;000) ✗ 02/02/17
Li4SeO5 ICSD 410714 C2/c (15) ✔ 20 96 1 2.9133 3.020 0.000 (0;000) ✗ 27/01/17
Rb3TaO8 ICSD 150280 I-42m (121) ✗ 12 88 1 2.9156 3.105 0.000 (0;000) ✗ 07/10/16
SrSiN2 COD 4343851 P2_1/c (14) ✔ 16 96 1 2.9169 3.060 0.000 (0;000) ✗ 02/02/17
RbH COD 9008709 Fm-3m (225) ✔ 2 10 1 2.9175 2.918 0.000 (0;000) ✗ 27/01/17
CsSn2Cl5 COD 1525543 I4/mcm (140) ✔ 16 144 2 2.919 3.043 0.000 (0;000) ✗ 02/02/17
H5C3BrN COD 7101076 P-1 (2) ✔ 20 58 1 2.9198 2.977 0.000 (0;000) ✗ 02/02/17
TiO2 COD 1528778 C2/m (12) ✔ 12 96 3 2.9207 3.025 0.000 (0;000) ✗ 27/01/17