≤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
BaNi2(PO4)2 COD 2008469 R-3 (148) ✔ 13 88 2 0.0 0.007 0.116 (0;000) ✗ 05/01/17
BaV2(NiO4)2 COD 2002114 R-3 (148) ✔ 13 104 2 0.0154 0.027 0.000 (0;111) ✗ 05/01/17
Ba(NiP)2 ICSD 85408 I4/mmm (139) ✔ 5 40 2 0.0 0.013 0.833 (1;111) ✗ 05/01/17
Ba(NiP2)2 ICSD 79105 I4/mmm (139) ✔ 7 50 2 0.0 0.004 0.466 (0;000) ✗ 05/01/17
Ba(NiO2)4 ICSD 20898 R-3m (166) ✔ 13 98 2 0.0 0.002 0.827 (1;111) ✗ 05/01/17
BaNiO2 COD 1527692 Cmcm (63) ✔ 8 64 2 0.0 0.025 0.027 (0;000) ✗ 05/01/17
C3N4 ICSD 246660 R3m (160) ✗ 7 32 2 1.2528 1.275 0.000 (0;000) ✗ 06/10/16
HfPd5 ICSD 168289 Cmmm (65) ✔ 6 62 2 0.0 0.001 0.683 (1;111) ✗ 06/10/16
HfS2 ICSD 601164 P-3m1 (164) ✔ 3 24 2 0.9936 1.854 0.000 (0;000) ✗ 06/10/16
BaNiS2 COD 4123984 P4/nmm (129) ✔ 8 64 2 0.0 0.020 0.175 (0;001) ✗ 05/01/17
PtO2 ICSD 24923 P6_3mc (186) ✗ 6 44 2 1.4599 1.605 0.000 (0;000) ✗ 06/10/16
HfS2 ICSD 638847 P-3m1 (164) ✔ 3 24 2 1.0013 1.870 0.000 (0;000) ✗ 27/01/17
HfS3 ICSD 638846 P2_1/m (11) ✔ 8 60 2 0.0 0.056 0.282 (1;010) ✗ 27/01/17
HfTe5 ICSD 85508 Cmcm (63) ✔ 12 84 2 0.0829 0.086 0.000 (1;110) ✗ 06/10/16
HfSe2 ICSD 182678 P-3m1 (164) ✔ 3 24 2 0.0662 1.151 0.000 (0;000) ✗ 27/01/17
BaSn(PO4)2 COD 7001616 C2/m (12) ✔ 12 82 2 4.3034 4.396 0.000 (0;000) ✗ 05/01/17
BaZr(PO4)2 ICSD 153124 C2/m (12) ✔ 12 72 2 4.2542 4.311 0.000 (0;000) ✗ 05/01/17
HfSiTe ICSD 25737 P4/nmm (129) ✔ 6 44 2 0.0 0.031 0.167 (0;001) ✗ 27/01/17
BaZr(PO4)2 ICSD 173842 P-3m1 (164) ✔ 12 72 2 3.7473 3.815 0.000 (0;000) ✗ 05/01/17
Ba(SbO3)2 COD 2009658 P-31m (162) ✔ 9 56 2 3.3588 3.441 0.000 (0;000) ✗ 05/01/17
HfTe2 ICSD 603713 P-3m1 (164) ✔ 3 24 2 0.0 0.022 0.297 (1;000) ✗ 27/01/17
BaZnSO COD 4310117 Cmcm (63) ✔ 8 68 2 2.2859 2.344 0.000 (0;000) ✗ 05/01/17
Ba(PPd)2 ICSD 36375 P4/mmm (123) ✔ 5 56 2 0.0 0.007 0.588 (0;110) ✗ 05/01/17
Ba(PRh)2 ICSD 50188 I4/mmm (139) ✔ 5 54 2 0.0 0.018 0.654 (1;000) ✗ 05/01/17
Ba(PRu)2 ICSD 602127 I4/mmm (139) ✔ 5 52 2 0.0 0.019 0.532 (1;111) ✗ 05/01/17
Ba(ZnP)2 COD 7221353 I4/mmm (139) ✔ 5 44 2 0.0 0.286 0.109 (0;000) ✗ 05/01/17
Ba(P2Pd)2 ICSD 75020 I4/mmm (139) ✔ 7 66 2 0.0 0.025 0.332 (0;000) ✗ 05/01/17
Ba(POs)2 ICSD 602106 I4/mmm (139) ✔ 5 52 2 0.0 0.013 0.559 (1;111) ✗ 05/01/17
BaZnPb COD 1527802 P6_3/mmc (194) ✔ 6 72 2 0.0 0.007 0.168 (1;000) ✗ 05/01/17
MoCl3 COD 5910110 C2/m (12) ✔ 8 70 2 0.0 0.038 0.023 (0;000) ✗ 27/01/17
CrSe2 ICSD 626718 P-3m1 (164) ✔ 3 26 2 0.0 0.094 0.232 (1;001) ✗ 27/01/17
TlI ICSD 26761 Ccmm (63) ✔ 4 40 2 1.4715 1.656 0.000 (0;000) ✗ 06/10/16
BaSi2 COD 1527353 P-3m1 (164) ✔ 3 18 2 0.0 0.020 0.229 (0;001) ✗ 05/01/17
BaSn5 ICSD 107305 P6/mmm (191) ✔ 6 80 2 0.0 0.010 0.705 (1;001) ✗ 05/01/17
BaZnSi COD 1527803 P6_3/mmc (194) ✔ 6 52 2 0.0 0.001 0.295 (0;000) ✗ 05/01/17
BaZnSn COD 1527804 P6_3/mmc (194) ✔ 6 72 2 0.0 0.002 0.266 (1;000) ✗ 05/01/17
Cs2O COD 9009127 R-3m (166) ✔ 3 24 2 1.3737 2.086 0.000 (0;000) ✗ 27/01/17
Cs2HgO2 ICSD 25513 I4/mmm (139) ✔ 5 42 2 1.9742 1.974 0.000 (0;000) ✗ 27/01/17
Cs2HgF4 ICSD 72353 I4/mmm (139) ✔ 7 58 2 2.1116 3.524 0.000 (0;000) ✗ 27/01/17
LaI3 ICSD 31596 Cmcm (63) ✔ 8 48 2 1.1147 1.359 0.000 (0;000) ✗ 06/10/16
SbI3 ICSD 26082 R-3 (148) ✔ 8 52 2 1.7182 1.827 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
FeSiO4 ICSD 186518 P2_1nm (31) ✗ 12 72 2 0.0 0.025 0.586 (0;000) ✔ 06/10/16
Sc2C ICSD 280743 P-3m1 (164) ✔ 3 26 2 0.0 0.001 0.283 (1;001) ✗ 27/01/17
Ta2CS2 ICSD 23791 R-3m (166) ✔ 5 42 2 0.0 0.045 0.371 (1;111) ✗ 27/01/17
Ta2CS2 ICSD 23790 P-3m1 (164) ✔ 5 42 2 0.0 0.028 0.262 (1;001) ✗ 27/01/17
CsCuO2 COD 1527507 Cmcm (63) ✔ 8 64 2 0.9188 1.187 0.000 (0;000) ✗ 27/01/17
CsCu3S2 ICSD 23326 P-3m1 (164) ✔ 6 54 2 1.6265 2.016 0.000 (0;000) ✗ 27/01/17
CsCu3O2 ICSD 413342 P-3m1 (164) ✔ 6 54 2 1.5592 1.641 0.000 (0;000) ✗ 27/01/17
CsZn4P3 COD 4326067 P4/mmm (123) ✔ 8 72 2 0.0592 0.059 0.000 (0;000) ✗ 27/01/17
CsSb(PO4)2 ICSD 202813 P-3 (147) ✔ 12 72 2 3.6081 3.731 0.000 (0;000) ✗ 27/01/17
LiHPd ICSD 246613 P4/mmm (123) ✔ 3 22 2 0.0 0.020 0.495 (1;000) ✗ 27/01/17
FePSe3 ICSD 16246 R3 (146) ✗ 10 62 2 0.1664 0.212 0.000 (0;000) ✔ 06/10/16
CsV(SO4)2 ICSD 73736 P-3 (147) ✔ 12 82 2 0.0 0.024 0.435 (0;000) ✗ 27/01/17
InGaS3 ICSD 62340 Ccm2_1 (36) ✗ 10 88 2 1.6062 1.706 0.000 (0;000) ✗ 06/10/16
CuP2 ICSD 628625 P2_1/c (14) ✔ 12 84 2 0.8546 0.855 0.000 (0;000) ✗ 27/01/17
CrBr2 ICSD 23903 C2/m (12) ✔ 3 28 2 0.0 0.045 0.565 (0;000) ✔ 27/01/17
LiCu2P ICSD 628282 P-3m1 (164) ✔ 8 60 2 0.0 0.001 0.184 (1;000) ✗ 27/01/17
Na3Cu2SbO6 ICSD 153037 C2/m (12) ✔ 12 90 2 0.0 0.029 0.015 (0;000) ✗ 27/01/17
Na2Cu2TeO6 COD 4309206 C2/m (12) ✔ 11 82 2 0.0768 0.144 0.000 (0;000) ✗ 27/01/17
LaS ICSD 77831 Ccme (64) ✔ 8 36 2 0.0 0.000 0.635 (1;000) ✗ 06/10/16
YBi2BrO4 ICSD 92418 P4/mmm (123) ✔ 8 72 2 1.1464 1.579 0.000 (0;000) ✗ 05/01/17
Ca(MgBi)2 COD 7221203 P-3m1 (164) ✔ 5 60 2 0.0171 0.017 0.000 (0;000) ✗ 05/01/17
Ca(MnBi)2 ICSD 41791 P-3m1 (164) ✔ 5 70 2 0.0 0.008 0.603 (1;001) ✗ 05/01/17
InBi2S4Cl ICSD 484 C2/m (12) ✔ 8 74 2 1.5901 1.742 0.000 (0;000) ✗ 05/01/17
YBi2ClO4 ICSD 92405 P4/mmm (123) ✔ 8 72 2 1.2683 1.494 0.000 (0;000) ✗ 05/01/17
Li3YBi2 ICSD 616795 P-3m1 (164) ✔ 6 50 2 0.0 0.051 0.212 (1;000) ✗ 05/01/17
Sr(MgBi)2 ICSD 616807 P-3m1 (164) ✔ 5 60 2 0.0348 0.035 0.000 (0;000) ✗ 05/01/17
Mg3Bi2 ICSD 659569 P-3m1 (164) ✔ 5 60 2 0.0 0.173 0.176 (1;000) ✗ 05/01/17
Bi2Pd COD 9012857 I4/mmm (139) ✔ 3 48 2 0.0 0.384 0.383 (1;000) ✗ 05/01/17
Bi2TeSe2 COD 9004849 R-3m (166) ✔ 5 48 2 0.1758 0.318 0.000 (1;000) ✗ 05/01/17
Bi2Se3 COD 9011965 R-3m (166) ✔ 5 48 2 0.2711 0.347 0.000 (1;000) ✗ 05/01/17
Bi2Te2Se ICSD 43512 R-3m (166) ✔ 5 48 2 0.2809 0.290 0.000 (1;000) ✗ 05/01/17
Bi2Te2S COD 9008043 R-3m (166) ✔ 5 48 2 0.2724 0.346 0.000 (1;000) ✗ 05/01/17
Bi2Te3 COD 9011962 R-3m (166) ✔ 5 48 2 0.1253 0.128 0.000 (1;000) ✗ 05/01/17
BiBrO COD 9009161 P4/nmm (129) ✔ 6 56 2 1.8229 1.982 0.000 (0;000) ✗ 05/01/17
LaTe3 ICSD 642014 Ccmm (63) ✔ 8 42 2 0.0 0.000 0.968 (1;000) ✗ 06/10/16
CaCuBi ICSD 57018 P6_3/mmc (194) ✔ 6 72 2 0.0 0.013 0.213 (1;000) ✗ 05/01/17
BiPbClO2 COD 9012425 Cmcm (63) ✔ 10 96 2 1.7889 1.813 0.000 (0;000) ✗ 05/01/17
BiClO COD 4509949 P4/nmm (129) ✔ 6 56 2 2.3075 2.699 0.000 (0;000) ✗ 05/01/17
CdI2 ICSD 38116 P6_3mc (186) ✗ 6 52 2 1.9181 2.127 0.000 (0;000) ✗ 06/10/16
SrCuBi ICSD 58777 P6_3/mmc (194) ✔ 6 72 2 0.0 0.001 0.153 (1;000) ✗ 05/01/17
Li2O2 ICSD 24143 P6_3/mmc (194) ✔ 8 36 2 2.7201 2.720 0.000 (0;000) ✗ 06/10/16
InBi COD 1527695 P4/nmm (129) ✔ 4 56 2 0.0 0.005 0.282 (0;000) ✗ 05/01/17
AuSe ICSD 73669 C2/m (12) ✔ 4 34 2 0.0 0.719 0.042 (0;000) ✔ 06/10/16
NaBi ICSD 616837 P4/mmm (123) ✔ 2 24 2 0.0 0.099 0.424 (1;000) ✗ 05/01/17
HfGeTe4 ICSD 241122 Cmc2_1 (36) ✗ 12 80 2 0.1165 0.169 0.000 (0;000) ✔ 06/10/16
CdP4 ICSD 25605 P2_1/c (14) ✔ 10 64 2 0.4602 0.528 0.000 (0;000) ✔ 06/10/16
RbBiS2 ICSD 52735 R-3m (166) ✔ 4 36 2 1.0427 1.171 0.000 (0;000) ✗ 05/01/17
TlBiS2 COD 2209681 R-3m (166) ✔ 4 40 2 0.0991 0.099 0.000 (1;000) ✗ 05/01/17
K3Cu3P2 COD 7221376 R-3m (166) ✔ 8 70 2 1.2649 1.324 0.000 (0;000) ✗ 27/01/17
MoS2 ICSD 24000 P6_3/mmc (194) ✔ 6 52 2 0.8501 1.709 0.000 (0;000) ✗ 06/10/16
MoS2 ICSD 26622 R-3m (166) ✔ 3 26 2 0.0 0.053 0.331 (1;111) ✗ 27/01/17
Te2Mo ICSD 14349 P2_1/m (11) ✔ 12 104 2 0.0 0.034 0.170 (0;000) ✗ 06/10/16
ZrGeTe4 ICSD 240906 Cmc2_1 (36) ✗ 12 64 2 0.0 0.116 0.024 (0;000) ✔ 06/10/16
BN ICSD 236992 P6_3/mmc (194) ✔ 4 16 2 4.2811 4.562 0.000 (0;000) ✗ 27/01/17
PbS ICSD 183243 R3m (160) ✗ 2 20 2 0.9607 0.966 0.000 (0;000) ✗ 06/10/16
PdN2 ICSD 191244 Pnnm (58) ✔ 6 40 2 0.0 0.013 0.578 (0;000) ✗ 06/10/16
CdBr2 COD 9009124 R-3m (166) ✔ 3 26 2 2.7703 2.910 0.000 (0;000) ✗ 27/01/17
FeBr2 COD 9009102 P-3m1 (164) ✔ 3 22 2 0.3824 0.406 0.000 (0;000) ✗ 27/01/17