≤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
CsBiO2 ICSD 406564 C2/c (15) ✔ 8 72 1 2.3819 2.391 0.000 (0;000) ✗ 05/01/17
LiBiF6 COD 1527496 R-3 (148) ✔ 8 60 1 4.6256 4.696 0.000 (0;000) ✗ 05/01/17
NO2 ICSD 28331 P2_1/c (14) ✔ 12 68 1 2.5717 2.624 0.000 (0;000) ✗ 27/01/17
KLi6BiO6 ICSD 72840 R-3m (166) ✔ 14 78 1 2.0022 2.002 0.000 (0;000) ✗ 05/01/17
KMgBi ICSD 616748 P4/nmm (129) ✔ 6 68 1 0.0 0.015 0.028 (1;000) ✗ 05/01/17
KMnBi ICSD 601586 P4/nmm (129) ✔ 6 78 1 0.0 0.000 0.834 (1;000) ✗ 05/01/17
Li2Ga ICSD 100051 Cmcm (63) ✔ 6 38 1 0.0 0.000 0.778 (1;110) ✗ 06/10/16
NaBiO3 COD 1526788 R-3 (148) ✔ 10 84 1 1.4476 1.542 0.000 (0;000) ✗ 05/01/17
RbBiO2 ICSD 407208 C2/c (15) ✔ 8 72 1 2.0422 2.042 0.000 (0;000) ✗ 05/01/17
SrBiO3 COD 2000656 Cmcm (63) ✔ 10 86 1 0.0 0.000 0.951 (1;110) ✗ 05/01/17
KNa2BN2 ICSD 236557 I4/mmm (139) ✔ 6 40 1 1.9048 2.280 0.000 (0;000) ✗ 05/01/17
LiB ICSD 236960 P6_3/mmc (194) ✔ 4 12 1 0.0 0.002 0.218 (0;000) ✗ 27/01/17
KNa2BO3 ICSD 33261 Pmmn (59) ✔ 14 96 1 2.9589 3.196 0.000 (0;000) ✗ 05/01/17
K2CdPb ICSD 10041 C2cm (40) ✗ 8 88 1 0.1156 0.312 0.000 (0;000) ✔ 05/12/16
K2CdSn ICSD 620066 C2cm (40) ✗ 8 88 1 0.0462 0.306 0.000 (0;000) ✔ 05/12/16
LiBO2 COD 2310701 P2_1/c (14) ✔ 16 72 1 5.6407 5.641 0.000 (0;000) ✗ 27/01/17
Ca3SiBr2 COD 1521782 Immm (71) ✔ 6 48 1 0.0 0.012 0.022 (1;000) ✗ 27/01/17
Ca3SiBr2 COD 1521781 I4/mmm (139) ✔ 6 48 1 0.0 0.005 0.315 (0;111) ✗ 27/01/17
RbHF2 ICSD 45859 I4/mcm (140) ✔ 8 48 1 6.8504 6.883 0.000 (0;000) ✗ 27/01/17
CsBr2F ICSD 84019 P4/mmm (123) ✔ 4 30 1 1.4039 1.404 0.000 (0;000) ✗ 27/01/17
Li5Br2N ICSD 78836 Immm (71) ✔ 8 34 1 2.2057 2.383 0.000 (0;000) ✗ 27/01/17
K4Br2O COD 9007797 Fmmm (69) ✔ 7 56 1 0.7286 0.729 0.000 (0;000) ✗ 27/01/17
Na4Br2O ICSD 67283 I4/mmm (139) ✔ 7 56 1 2.068 2.068 0.000 (0;000) ✗ 27/01/17
KClO3 ICSD 188311 R3m (160) ✗ 5 34 1 4.7094 4.710 0.000 (0;000) ✗ 06/10/16
Mg3Ge ICSD 70070 P-1 (2) ✔ 8 68 1 0.0 0.000 0.605 (0;000) ✗ 06/10/16
MnClO3 ICSD 416749 Ccm2_1 (36) ✗ 10 80 1 0.0 1.599 1.000 (0;000) ✔ 06/10/16
RbClO3 ICSD 10283 R3m (160) ✗ 5 34 1 5.3969 5.397 0.000 (0;000) ✗ 06/10/16
RbClO3 ICSD 36260 R3m (160) ✗ 5 34 1 5.3577 5.830 0.000 (0;000) ✗ 06/10/16
TlClO3 ICSD 76434 R3m (160) ✗ 5 38 1 3.9476 4.010 0.000 (0;000) ✗ 06/10/16
CsCaBr3 ICSD 77242 Pm-3m (221) ✔ 5 40 1 4.484 4.646 0.000 (0;000) ✗ 27/01/17
Cr(ClO)2 ICSD 416750 P2_1 (4) ✗ 10 80 1 0.0 2.337 1.000 ? ✗ 06/10/16
S(ClO)2 ICSD 62970 F2dd (43) ✗ 10 64 1 4.2223 4.232 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
Cs3LiCl4 ICSD 245969 Cm2m (38) ✗ 8 58 1 4.5309 4.531 0.000 (0;000) ✗ 28/10/16
ReNCl4 ICSD 10126 P1 (1) ✗ 6 48 1 1.098 1.204 0.000 (0;000) ✗ 06/10/16
PH4Br ICSD 23691 P4/nmm (129) ✔ 12 32 1 3.9308 4.105 0.000 (0;000) ✗ 27/01/17
H4BrN ICSD 27724 P4/nmm (129) ✔ 12 32 1 3.0741 3.074 0.000 (0;000) ✗ 27/01/17
SrBrF ICSD 35392 P4/nmm (129) ✔ 6 48 1 5.0428 5.043 0.000 (0;000) ✗ 27/01/17
HBr COD 1010385 Fm-3m (225) ✔ 2 8 1 0.0 0.000 0.199 (0;000) ✗ 27/01/17
Na2Zr(CuS2)2 ICSD 79536 C2/m (12) ✔ 9 68 1 0.0 0.012 0.006 (1;000) ✗ 27/01/17
SrHBr COD 9009182 P4/nmm (129) ✔ 6 36 1 3.9561 3.979 0.000 (0;000) ✗ 27/01/17
SrHBrO ICSD 407720 C2/m (12) ✔ 8 48 1 4.3807 4.381 0.000 (0;000) ✗ 27/01/17
Li3BrO ICSD 67265 Pm-3m (221) ✔ 5 22 1 4.0589 4.319 0.000 (0;000) ✗ 27/01/17
KBr COD 9009734 Fm-3m (225) ✔ 2 16 1 4.2926 4.293 0.000 (0;000) ✗ 27/01/17
BrN COD 9016337 Pm-3m (221) ✔ 2 12 1 0.0 0.007 0.619 (0;000) ✗ 27/01/17
RbAg3Te2 COD 1510038 C2/m (12) ✔ 12 108 1 0.2065 0.207 0.000 (0;000) ✗ 30/01/17
CsNO2 ICSD 50327 P3_121 (152) ✗ 12 78 1 2.4684 2.661 0.000 (0;000) ✗ 28/10/16
CsNO2 ICSD 50328 P3_121 (152) ✗ 12 78 1 2.8488 3.021 0.000 (0;000) ✗ 28/10/16
Cs3Li2F5 ICSD 245964 Fmm2 (42) ✗ 10 68 1 5.7163 5.847 0.000 (0;000) ✗ 28/10/16
SrGe ICSD 43099 Cmcm (63) ✔ 4 28 1 0.0 0.034 0.168 (0;110) ✗ 06/10/16
NaGaH8(NF3)2 ICSD 418737 Fm-3m (225) ✔ 18 82 1 6.2519 6.252 0.000 (0;000) ✗ 27/01/17
RbBr ICSD 61560 Pm-3m (221) ✔ 2 16 1 4.1418 4.159 0.000 (0;000) ✗ 27/01/17
TlAgI2 COD 1509391 I4/mcm (140) ✔ 8 76 1 1.1422 1.142 0.000 (0;000) ✗ 30/01/17
KCuS ICSD 49008 P2_1cn (33) ✗ 12 104 1 1.8268 1.849 0.000 (0;000) ✗ 06/10/16
Br COD 1512496 Cmce (64) ✔ 4 28 1 1.1847 1.185 0.000 (0;000) ✗ 27/01/17
Br COD 9013118 Cmce (64) ✔ 4 28 1 1.7043 1.768 0.000 (0;000) ✗ 27/01/17
K2TaAgS4 ICSD 84294 Fddd (70) ✔ 16 132 1 2.5212 2.523 0.000 (0;000) ✗ 30/01/17
K5Ag(NO)2 ICSD 73296 Pbam (55) ✔ 20 156 1 0.0 0.001 0.373 (0;000) ✗ 30/01/17
RbBr COD 9008706 Fm-3m (225) ✔ 2 16 1 4.2029 4.203 0.000 (0;000) ✗ 27/01/17
TlBr COD 9008825 Pm-3m (221) ✔ 2 20 1 1.2438 1.649 0.000 (0;000) ✗ 27/01/17
KAgC2 ICSD 410874 P4/mmm (123) ✔ 4 28 1 2.3634 2.681 0.000 (0;000) ✗ 27/01/17
CsAuC2 ICSD 411251 P4/mmm (123) ✔ 4 28 1 1.6056 1.606 0.000 (0;000) ✗ 27/01/17
NaTl2RhF6 ICSD 27340 Fm-3m (225) ✔ 10 94 1 1.6166 1.617 0.000 (0;000) ✗ 27/01/17
RbAuC2 ICSD 411252 P4/mmm (123) ✔ 4 28 1 1.7472 1.828 0.000 (0;000) ✗ 27/01/17
KTlO COD 1528008 C2/m (12) ✔ 6 56 1 1.2719 1.734 0.000 (0;000) ✗ 27/01/17
BaC2 ICSD 186576 R-3m (166) ✔ 3 18 1 1.1314 1.919 0.000 (0;000) ✗ 27/01/17
As2Se3 ICSD 611373 C2/m (12) ✔ 10 56 1 0.5143 0.533 0.000 (0;000) ✗ 30/01/17
CaC2 COD 1010500 Pn-3m (224) ✔ 12 72 1 1.7564 2.259 0.000 (0;000) ✗ 27/01/17
Cs(CO)2 ICSD 154357 C2/m (12) ✔ 10 58 1 2.7093 2.798 0.000 (0;000) ✗ 27/01/17
RbCuC2 ICSD 391118 P4/mmm (123) ✔ 4 28 1 1.9709 2.051 0.000 (0;000) ✗ 27/01/17
Be(H3C)2 COD 5900008 Ibam (72) ✔ 18 36 1 4.8496 4.850 0.000 (0;000) ✗ 27/01/17
H4C2NO2 ICSD 172054 C2/m (12) ✔ 18 58 1 2.951 2.996 0.000 (0;000) ✗ 27/01/17
H(CO)2 ICSD 151146 P2_1/m (11) ✔ 20 84 1 2.7476 2.853 0.000 (0;000) ✗ 27/01/17
Ca3PN COD 1527232 Pm-3m (221) ✔ 5 40 1 0.8179 0.818 0.000 (0;000) ✗ 27/01/17
BaC2 ICSD 88102 C2/c (15) ✔ 6 36 1 1.9008 2.015 0.000 (0;000) ✗ 27/01/17
Li(CO)2 ICSD 154354 C2/m (12) ✔ 10 46 1 2.1698 2.525 0.000 (0;000) ✗ 27/01/17
HBr ICSD 28842 Fmmm (69) ✔ 2 8 1 0.0 0.014 0.282 (0;000) ✗ 06/10/16
Na2Mg(CO3)2 COD 9009293 R-3 (148) ✔ 11 72 1 4.5324 4.554 0.000 (0;000) ✗ 27/01/17
NaCu3Te2 ICSD 60860 R3m (160) ✗ 6 54 1 0.0 0.052 0.021 (0;111) ✔ 06/10/16
HCl ICSD 28844 Fmmm (69) ✔ 2 8 1 0.0 0.033 0.154 (1;000) ✗ 06/10/16
SrC2 COD 1522125 I4/mmm (139) ✔ 3 18 1 1.9456 2.680 0.000 (0;000) ✗ 27/01/17
SrC2 COD 1522127 C2/c (15) ✔ 6 36 1 2.457 2.716 0.000 (0;000) ✗ 27/01/17
CaC2 ICSD 24074 C2/c (15) ✔ 6 36 1 2.3901 2.972 0.000 (0;000) ✗ 06/10/16
LiCa2HC3 ICSD 261184 P4/mbm (127) ✔ 14 72 1 1.2698 1.552 0.000 (0;000) ✗ 27/01/17
Ca3N2 ICSD 419865 R-3c (167) ✔ 10 80 1 0.792 0.955 0.000 (0;000) ✗ 27/01/17
Hg(C2F3)2 ICSD 165635 P-1 (2) ✔ 11 70 1 3.4881 3.797 0.000 (0;000) ✗ 27/01/17
Ca2NCl ICSD 62555 R-3m (166) ✔ 4 32 1 2.3335 2.334 0.000 (0;000) ✗ 27/01/17
C5S3 COD 4109719 Immm (71) ✔ 8 38 1 0.0 0.005 0.705 (0;111) ✗ 27/01/17
Ca2CrN3 COD 7012864 P-1 (2) ✔ 12 98 1 0.9093 1.042 0.000 (0;000) ✗ 27/01/17
Ca2FeN2 ICSD 72389 C2/m (12) ✔ 10 76 1 0.0 0.006 0.480 (0;111) ✗ 27/01/17
CaC2 ICSD 290833 C2/m (12) ✔ 6 36 1 2.378 2.794 0.000 (0;000) ✗ 06/10/16
Ca2InN COD 1531106 Cmcm (63) ✔ 8 76 1 0.0 0.119 0.326 (0;110) ✗ 27/01/17
Ca2PbO4 COD 2002530 Pbam (55) ✔ 14 116 1 1.7129 1.926 0.000 (0;000) ✗ 27/01/17
Ca2ZnN2 COD 1005002 I4/mmm (139) ✔ 5 42 1 0.7565 0.981 0.000 (0;000) ✗ 27/01/17
Tl2O ICSD 77699 C2/m (12) ✔ 6 64 1 0.402 0.482 0.000 (0;000) ✔ 06/10/16
Ca2SnO4 COD 1529022 Pbam (55) ✔ 14 116 1 3.0356 3.056 0.000 (0;000) ✗ 27/01/17
Ca2Pt3O8 ICSD 65412 R-3m (166) ✔ 13 98 1 1.149 1.308 0.000 (0;000) ✗ 27/01/17
Ca3PCl3 COD 1530047 Pm-3m (221) ✔ 7 56 1 1.8056 1.806 0.000 (0;000) ✗ 27/01/17
Ca3(PO4)2 COD 9005865 R-3m (166) ✔ 13 88 1 5.5912 5.591 0.000 (0;000) ✗ 27/01/17
KAg3Se2 COD 8103421 C2/m (12) ✔ 12 108 1 0.0 0.023 0.017 (0;000) ✗ 30/01/17