≤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
NiBr2 COD 9008013 R-3m (166) ✔ 3 24 2 0.0 0.031 0.538 (0;000) ✗ 27/01/17
TiBr2 ICSD 26078 P-3m1 (164) ✔ 3 26 2 0.0 0.005 0.539 (0;000) ✗ 27/01/17
MgBr2 COD 9009107 P-3m1 (164) ✔ 3 24 2 4.1115 4.112 0.000 (0;000) ✗ 27/01/17
ZnBr2 COD 9011540 R-3m (166) ✔ 3 26 2 2.4418 2.445 0.000 (0;000) ✗ 27/01/17
Li2FeBr4 ICSD 82199 Cmmm (65) ✔ 7 42 2 0.4178 0.418 0.000 (0;000) ✗ 27/01/17
Li2MgBr4 ICSD 73276 Cmmm (65) ✔ 7 44 2 4.4109 4.411 0.000 (0;000) ✗ 27/01/17
SrHgO2 ICSD 69739 P3_2 (145) ✗ 12 102 2 2.4955 2.570 0.000 (0;000) ✗ 06/10/16
CrSBr ICSD 69659 Pmmn (59) ✔ 6 54 2 0.0 0.000 0.938 (0;000) ✗ 27/01/17
CuHOF ICSD 98698 P2_1/c (14) ✔ 16 100 2 0.0 0.052 0.272 (0;010) ✗ 27/01/17
CuBr COD 9013931 P4/nmm (129) ✔ 4 36 2 0.7515 0.752 0.000 (0;000) ✗ 27/01/17
PbBrF COD 9009175 P4/nmm (129) ✔ 6 56 2 2.2754 2.275 0.000 (0;000) ✗ 27/01/17
HfBrN COD 1532008 Pmmn (59) ✔ 6 48 2 2.226 2.226 0.000 (0;000) ✗ 27/01/17
HfBrN ICSD 190383 R-3m (166) ✔ 6 48 2 1.8563 2.445 0.000 (0;000) ✗ 27/01/17
InBrO ICSD 24059 Pmmn (59) ✔ 6 52 2 2.2656 2.325 0.000 (0;000) ✗ 27/01/17
ZrBrN ICSD 27393 Pmmn (59) ✔ 6 32 2 1.224 1.224 0.000 (0;000) ✗ 27/01/17
TiBrN ICSD 27395 Pmmn (59) ✔ 6 48 2 0.1946 0.195 0.000 (0;000) ✗ 27/01/17
ZrBrN ICSD 51771 R-3m (166) ✔ 6 32 2 1.2522 1.887 0.000 (0;000) ✗ 27/01/17
ScBrO COD 2206575 Pmmn (59) ✔ 6 48 2 3.3438 3.344 0.000 (0;000) ✗ 27/01/17
TiBrO COD 1523160 Pmmn (59) ✔ 6 50 2 0.0 0.000 0.900 (0;001) ✗ 27/01/17
VBrO ICSD 27010 Pmmn (59) ✔ 6 52 2 0.0 0.005 0.462 (0;001) ✗ 27/01/17
PbS ICSD 183249 Pbm2 (28) ✗ 8 80 2 0.8462 1.424 0.000 (0;000) ✗ 06/10/16
ZrBr COD 4343762 R-3m (166) ✔ 4 22 2 0.0 0.043 0.167 (0;111) ✗ 27/01/17
PbS ICSD 183255 P6_3mc (186) ✗ 4 40 2 0.8123 1.012 0.000 (0;000) ✗ 06/10/16
LiCuO2 ICSD 74978 C2/m (12) ✔ 4 26 2 0.4034 0.819 0.000 (0;000) ✗ 27/01/17
KCuO2 COD 1530993 Cmcm (63) ✔ 8 64 2 0.923 1.302 0.000 (0;000) ✗ 27/01/17
NaInS2 ICSD 640037 R-3m (166) ✔ 4 34 2 1.9197 2.109 0.000 (0;000) ✗ 27/01/17
NaInSe2 ICSD 25558 R-3m (166) ✔ 4 34 2 1.0445 1.212 0.000 (0;000) ✗ 27/01/17
KCuTe COD 7221373 P6_3/mmc (194) ✔ 6 52 2 0.5401 0.540 0.000 (0;000) ✗ 27/01/17
PbS ICSD 68701 Cm2e (39) ✗ 4 40 2 1.0016 1.003 0.000 (0;000) ✗ 06/10/16
PbO ICSD 15402 Pmab (57) ✔ 8 80 2 1.8544 2.040 0.000 (0;000) ✗ 06/10/16
Ca(BC)2 ICSD 88019 I4/mcm (140) ✔ 10 48 2 0.4846 1.005 0.000 (0;000) ✗ 27/01/17
PbS ICSD 68712 C2 (5) ✗ 4 40 2 1.0591 1.094 0.000 (0;000) ✗ 06/10/16
PbO ICSD 62846 P4/nmm (129) ✔ 4 40 2 1.1693 2.163 0.000 (0;000) ✗ 06/10/16
BaMg(CO3)2 COD 9011458 R-3m (166) ✔ 10 64 2 4.0954 4.178 0.000 (0;000) ✗ 27/01/17
CaMg(CO3)2 COD 1200014 R-3 (148) ✔ 10 64 2 5.1415 5.552 0.000 (0;000) ✗ 27/01/17
NaCuO2 COD 1529687 C2/m (12) ✔ 4 32 2 0.5401 0.941 0.000 (0;000) ✗ 27/01/17
CaMg(CO3)2 COD 9001415 R-3 (148) ✔ 10 64 2 5.1156 5.545 0.000 (0;000) ✗ 27/01/17
PbSe ICSD 74334 F2mm (42) ✗ 4 40 2 0.9339 0.934 0.000 (0;000) ✗ 06/10/16
RbCuO2 COD 1527506 Cmcm (63) ✔ 8 64 2 0.9467 1.340 0.000 (0;000) ✗ 27/01/17
KCuC2 ICSD 412038 P4_2/mmc (131) ✔ 8 56 2 2.0604 2.060 0.000 (0;000) ✗ 27/01/17
Li2CuP COD 4000338 P6_3/mmc (194) ✔ 8 44 2 0.0 0.718 0.239 (0;000) ✗ 27/01/17
TePt ICSD 41383 C2/m (12) ✔ 4 32 2 0.0 0.077 0.748 (1;111) ✔ 06/10/16
Zn(H3C)2 ICSD 262113 P2_1/c (14) ✔ 18 52 2 4.5024 4.572 0.000 (0;000) ✗ 27/01/17
HgC2(SN)2 ICSD 10304 C2/m (12) ✔ 7 42 2 2.286 2.380 0.000 (0;000) ✗ 27/01/17
NbI2O ICSD 36255 C2 (5) ✗ 8 66 2 0.8298 0.837 0.000 (0;000) ✗ 06/10/16
VO2 ICSD 1501 P-1 (2) ✔ 12 100 2 0.0 0.011 0.534 (1;001) ✗ 06/10/16
Nb3TeI7 ICSD 86724 P3m1 (156) ✗ 11 94 2 0.4176 0.421 0.000 (0;000) ✔ 06/10/16
NbI3O ICSD 418088 C2 (5) ✗ 10 80 2 0.8135 0.850 0.000 (0;000) ✗ 06/10/16
Rb2NiF4 ICSD 69682 I4/mmm (139) ✔ 7 56 2 0.0 0.006 0.710 (0;000) ✗ 27/01/17
MgC2 ICSD 88057 P4_2/mnm (136) ✔ 6 36 2 2.874 3.338 0.000 (0;000) ✗ 27/01/17
NiC2(SN)2 ICSD 31320 C2/m (12) ✔ 7 40 2 0.0 0.014 0.451 (0;000) ✗ 27/01/17
NbInS2 ICSD 74702 P-6m2 (187) ✗ 4 38 2 0.0 0.014 0.412 (0;000) ✔ 06/10/16
NbInSe2 ICSD 640056 P-6m2 (187) ✗ 4 38 2 0.0 0.020 0.401 (0;000) ✔ 06/10/16
SrCuSb ICSD 53339 P6_3/mmc (194) ✔ 6 52 2 0.0 0.386 0.132 (0;000) ✗ 27/01/17
PbS ICSD 183240 Cmcm (63) ✔ 4 40 2 1.2082 1.208 0.000 (0;000) ✗ 27/01/17
BN ICSD 162883 P2_1/c (14) ✔ 8 32 2 3.1457 3.540 0.000 (0;000) ✗ 06/10/16
TlInS2 ICSD 654688 P6_3/mmc (194) ✔ 8 76 2 0.4358 1.181 0.000 (0;000) ✗ 27/01/17
HgH4C4(NCl)2 COD 2203719 C2/m (12) ✔ 13 56 2 2.1633 2.211 0.000 (0;000) ✗ 27/01/17
TlInS2 ICSD 25354 R-3m (166) ✔ 4 38 2 0.5619 1.248 0.000 (0;000) ✗ 27/01/17
PbS ICSD 183241 Pmnb (62) ✔ 8 80 2 0.9413 0.962 0.000 (0;000) ✗ 06/10/16
Ca4Ni3C5 ICSD 71440 C2/m (12) ✔ 12 90 2 0.0 0.047 0.184 (0;000) ✗ 27/01/17
Zn(InS2)2 ICSD 15636 R3m (160) ✗ 7 62 2 0.0 0.019 0.068 (1;000) ✔ 06/10/16
Rb2Te ICSD 55148 Cmc2_1 (36) ✗ 6 48 2 1.7077 1.708 0.000 (0;000) ✗ 06/10/16
Zn(InS2)2 ICSD 16974 R3m (160) ✗ 7 62 2 0.0 0.019 0.068 (1;000) ✔ 06/10/16
Zn(InS2)2 ICSD 42667 R3m (160) ✗ 7 62 2 0.0 0.011 0.068 (1;000) ✔ 06/10/16
CuTe COD 1526237 Pmmn (59) ✔ 4 34 2 0.0 0.000 0.915 (1;001) ✗ 27/01/17
Zn(InS2)2 ICSD 44637 P3m1 (156) ✗ 7 62 2 0.0 0.003 0.065 (1;000) ✔ 06/10/16
Rb2Te ICSD 55151 Ccm2_1 (36) ✗ 6 48 2 1.9925 1.993 0.000 (0;000) ✗ 06/10/16
Zn(InS2)2 ICSD 603024 R3m (160) ✗ 7 62 2 0.0 0.021 0.068 (1;000) ✔ 06/10/16
PHPb2F10 ICSD 419142 P-1 (2) ✔ 14 104 2 4.8537 5.026 0.000 (0;000) ✗ 27/01/17
Ca2GeO4 COD 1527982 I4/mmm (139) ✔ 7 48 2 3.1506 3.559 0.000 (0;000) ✗ 27/01/17
Ca2MgP2(H2O5)2 ICSD 156224 P-1 (2) ✔ 19 104 2 5.6684 5.802 0.000 (0;000) ✗ 27/01/17
Ca2RuH6 ICSD 656082 Fm-3m (225) ✔ 9 42 2 2.043 2.043 0.000 (0;000) ✗ 27/01/17
Ca2SiO4 ICSD 40657 I4/mmm (139) ✔ 7 48 2 4.5637 5.235 0.000 (0;000) ✗ 27/01/17
Zn(InS2)2 ICSD 640407 R3m (160) ✗ 7 62 2 0.0 0.007 0.206 ? ✗ 06/10/16
KHF2 COD 1010380 I4/mcm (140) ✔ 8 48 2 6.0591 6.586 0.000 (0;000) ✗ 27/01/17
GaH5(NF)2 ICSD 410880 C2/m (12) ✔ 20 84 2 3.1791 3.354 0.000 (0;000) ✗ 27/01/17
Ca3N2 ICSD 169727 P-3m1 (164) ✔ 5 40 2 0.4458 0.504 0.000 (0;000) ✗ 27/01/17
V2Te2O7F2 COD 2016941 P-1 (2) ✔ 13 94 2 0.0608 0.151 0.000 (0;000) ✗ 27/01/17
SrF2 ICSD 262349 Pnma (62) ✔ 12 96 2 0.0 0.001 0.071 (1;000) ✗ 27/01/17
SrF2 ICSD 168801 P6_3/mmc (194) ✔ 6 48 2 6.438 6.666 0.000 (0;000) ✗ 27/01/17
Ca(CdSb)2 COD 7221360 P-3m1 (164) ✔ 5 44 2 0.0 0.081 0.045 (0;000) ✗ 27/01/17
Ca(CdP)2 COD 7221218 P-3m1 (164) ✔ 5 44 2 0.8743 0.874 0.000 (0;000) ✗ 27/01/17
Ca(CoP)2 ICSD 10462 I4/mmm (139) ✔ 5 54 2 0.0 0.019 0.401 (0;111) ✗ 27/01/17
NaNiF3 COD 2300484 Cmcm (63) ✔ 10 80 2 0.0 0.002 0.706 (0;000) ✗ 27/01/17
SnS ICSD 67442 Cm2e (39) ✗ 4 40 2 1.0017 1.005 0.000 (0;000) ✗ 06/10/16
CaCuSb ICSD 42137 P6_3/mmc (194) ✔ 6 52 2 0.0 0.463 0.122 (0;000) ✗ 27/01/17
SnS ICSD 79374 C2me (39) ✗ 4 40 2 1.0723 1.072 0.000 (0;000) ✗ 06/10/16
KZnSb ICSD 44680 P-6m2 (187) ✗ 3 26 2 0.2326 0.390 0.000 (0;000) ✔ 06/10/16
K2Sn2O3 ICSD 2216 R3 (146) ✗ 7 64 2 0.8749 0.875 0.000 (0;000) ✗ 06/10/16
Ca(CuP)2 ICSD 41756 I4/mmm (139) ✔ 5 42 2 0.0 0.004 0.354 (1;111) ✗ 27/01/17
K2MgF4 ICSD 33519 I4/mmm (139) ✔ 7 56 2 6.6361 6.783 0.000 (0;000) ✗ 27/01/17
Ca(CuS)2 COD 4001658 P-3m1 (164) ✔ 5 44 2 1.0638 1.064 0.000 (0;000) ✗ 27/01/17
YS ICSD 69042 Fmm2 (42) ✗ 4 34 2 0.0 0.003 0.567 (0;111) ✔ 06/10/16
Rb2HgF4 ICSD 72352 I4/mmm (139) ✔ 7 58 2 1.7196 3.330 0.000 (0;000) ✗ 27/01/17
GaH4NF4 ICSD 410849 I4/mcm (140) ✔ 20 100 2 5.5819 5.673 0.000 (0;000) ✗ 27/01/17
RbFeF4 ICSD 85499 P4/mbm (127) ✔ 12 90 2 0.0 0.000 0.764 (0;000) ✗ 27/01/17
NaMnF4 COD 1008528 P2_1/c (14) ✔ 12 104 2 0.0 0.014 0.033 (0;000) ✗ 27/01/17
K2NiF4 COD 1527113 I4/mmm (139) ✔ 7 56 2 0.0 0.011 0.712 (0;000) ✗ 27/01/17
MgCl2 ICSD 51245 P-4m2 (115) ✗ 3 24 2 4.679 5.054 0.000 (0;000) ✗ 06/10/16