≤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
Ca(CO)4 ICSD 248078 I4_1/amd (141) ✔ 18 100 1 4.1602 4.205 0.000 (0;000) ✗ 02/02/17
Cu(CO)4 ICSD 415406 C2/c (15) ✔ 18 102 3 0.0 0.000 0.504 (1;011) ✗ 02/02/17
H4C4BrN COD 2003427 C2/m (12) ✔ 20 64 2 4.0401 4.124 0.000 (0;000) ✗ 02/02/17
H4C4SO COD 2010884 P-1 (2) ✔ 20 64 1 1.3594 1.421 0.000 (0;000) ✗ 02/02/17
Na3H5(CO2)4 ICSD 109935 P-1 (2) ✔ 20 96 1 4.5508 4.603 0.000 (0;000) ✗ 02/02/17
K3ReC4(N2O)2 ICSD 16121 P-1 (2) ✔ 14 90 1 2.574 2.574 0.000 (0;000) ✗ 02/02/17
K3ReC4(N2O)2 ICSD 30430 P-1 (2) ✔ 14 90 3 0.0 0.098 0.453 (0;000) ✗ 02/02/17
K3TcC4(N2O)2 ICSD 260824 P-1 (2) ✔ 14 90 1 2.2512 2.257 0.000 (0;000) ✗ 02/02/17
KC4N3 ICSD 77046 P-1 (2) ✔ 16 80 1 2.5789 2.580 0.000 (0;000) ✗ 02/02/17
KTl(CN)4 COD 4308988 I4_1/a (88) ✔ 20 116 1 5.7854 5.883 0.000 (0;000) ✗ 02/02/17
NaC4N3 ICSD 31926 P-1 (2) ✔ 16 80 1 3.6724 3.698 0.000 (0;000) ✗ 02/02/17
ZnNi(CN)4 ICSD 169760 P4_2/mcm (132) ✔ 20 116 3 2.7426 2.768 0.000 (0;000) ✗ 02/02/17
ZnPd(CN)4 ICSD 169759 P4_2/mcm (132) ✔ 20 132 3 4.4419 4.446 0.000 (0;000) ✗ 02/02/17
ZnPt(CN)4 ICSD 169758 P4_2/mcm (132) ✔ 20 116 3 3.7624 3.764 0.000 (0;000) ✗ 02/02/17
Pb(CO)4 ICSD 248144 I4_1/amd (141) ✔ 18 108 3 3.0547 3.410 0.000 (0;000) ✗ 02/02/17
Ru(CO)4 ICSD 72577 Ibam (72) ✔ 18 112 1 2.2438 2.285 0.000 (0;000) ✗ 02/02/17
Hf2Al3C5 ICSD 601454 P6_3/mmc (194) ✔ 20 106 3 0.0 0.000 0.794 (0;000) ✗ 02/02/17
Zr2Al3C5 ICSD 87349 P6_3/mmc (194) ✔ 20 74 3 0.0 0.000 0.853 (1;000) ✗ 02/02/17
H2C5SN COD 7200215 P-1 (2) ✔ 18 66 1 1.9486 2.273 0.000 (0;000) ✗ 02/02/17
Y4C5 ICSD 84869 Pbam (55) ✔ 18 128 3 0.0 0.005 0.807 (0;100) ✗ 02/02/17
CoAg3(CN)6 ICSD 28501 P-31m (162) ✔ 16 104 3 3.2465 3.377 0.000 (0;000) ✗ 02/02/17
K2NaAg3(CN)6 ICSD 65699 P-31m (162) ✔ 18 114 2 2.6697 2.670 0.000 (0;000) ✗ 02/02/17
Cd2Os(CN)6 ICSD 417821 P-3 (147) ✔ 15 94 3 1.8382 1.838 0.000 (0;000) ✗ 02/02/17
Cd2Ru(CN)6 ICSD 417822 P-3 (147) ✔ 15 94 3 2.2762 2.276 0.000 (0;000) ✗ 02/02/17
Cs2CdFe(CN)6 ICSD 151696 Fm-3m (225) ✔ 16 92 3 3.799 3.888 0.000 (0;000) ✗ 02/02/17
CdPd(CN)6 ICSD 6093 Fm-3m (225) ✔ 14 84 3 3.5232 3.633 0.000 (0;000) ✗ 02/02/17
CdPt(CN)6 COD 4100926 Fm-3m (225) ✔ 14 76 3 5.4883 5.640 0.000 (0;000) ✗ 02/02/17
Cs2LiCo(CN)6 ICSD 23204 Fm-3m (225) ✔ 16 92 2 4.0485 4.056 0.000 (0;000) ✗ 02/02/17
Cs2MgFe(CN)6 ICSD 6086 Fm-3m (225) ✔ 16 90 3 3.9146 4.111 0.000 (0;000) ✗ 02/02/17
Cs2FeNi(CN)6 ICSD 151706 Fm-3m (225) ✔ 16 90 3 0.0 0.000 0.652 (0;000) ✗ 02/02/17
Cs2LiIr(CN)6 ICSD 9032 Fm-3m (225) ✔ 16 92 2 5.3821 5.611 0.000 (0;000) ✗ 02/02/17
Cs2LiMn(CN)6 ICSD 68067 Fm-3m (225) ✔ 16 90 2 0.0 0.036 0.629 (0;000) ✗ 02/02/17
K2FeNi(CN)6 COD 1010372 Fm-3m (225) ✔ 16 90 3 0.0 0.000 0.507 (0;000) ✗ 02/02/17
Mn2Fe(CN)6 ICSD 417824 P-3 (147) ✔ 15 92 3 0.0 0.000 0.716 (0;000) ✗ 02/02/17
FePb2(CN)6 ICSD 51493 P-3 (147) ✔ 15 90 3 2.5974 2.672 0.000 (0;000) ✗ 02/02/17
FeSn2(CN)6 ICSD 51494 P-3 (147) ✔ 15 90 3 3.3964 3.449 0.000 (0;000) ✗ 02/02/17
CoH3(CN)6 ICSD 28502 P-31m (162) ✔ 16 74 3 4.1114 4.130 0.000 (0;000) ✗ 02/02/17
ZnPt(CN)6 COD 4100933 Fm-3m (225) ✔ 14 76 3 5.0929 5.194 0.000 (0;000) ✗ 02/02/17
ZnB2(CN)8 ICSD 415547 P-3m1 (164) ✔ 19 90 3 5.6043 5.632 0.000 (0;000) ✗ 02/02/17
RbC8 ICSD 200563 Fddd (70) ✔ 18 82 2 0.0 0.000 0.817 (1;111) ✗ 02/02/17
Ca2FeClO3 ICSD 56880 P4/nmm (129) ✔ 14 106 1 0.0 0.000 0.751 (0;000) ✗ 02/02/17
Ca2CoTeO6 ICSD 153001 P2_1/c (14) ✔ 20 158 3 0.0 0.000 0.864 (0;101) ✗ 02/02/17
Ca2CoWO6 ICSD 98732 P2_1/c (14) ✔ 20 174 3 0.0 0.000 0.983 (0;101) ✗ 02/02/17
CsCa2Ta3O10 ICSD 89011 P4/mmm (123) ✔ 16 128 2 2.3868 2.700 0.000 (0;000) ✗ 02/02/17
Ca2FeCuSeO3 ICSD 169993 P4/nmm (129) ✔ 16 126 1 0.0 0.000 0.835 (1;001) ✗ 02/02/17
Ca2FeCuSO3 ICSD 169992 P4/nmm (129) ✔ 16 126 1 0.0 0.000 0.902 (1;001) ✗ 02/02/17
Ca2Cu ICSD 108865 Pnma (62) ✔ 12 124 1 0.0 0.000 0.526 (1;011) ✗ 02/02/17
Ca2Zn2CuP3 ICSD 89517 P6_3/mmc (194) ✔ 16 140 2 0.2555 0.326 0.000 (0;000) ✗ 02/02/17
Ca2Fe7O11 COD 1524841 C2/m (12) ✔ 20 142 3 0.0 0.003 0.652 (0;001) ✗ 02/02/17
Ca2FeMoO6 ICSD 89956 P2_1/c (14) ✔ 20 156 3 0.2263 0.298 0.000 (0;000) ✗ 02/02/17
Ca2FeReO6 ICSD 150697 P2_1/c (14) ✔ 20 158 3 0.0 0.000 0.820 (0;101) ✗ 02/02/17
Ca2FeSbO6 ICSD 83473 P2_1/c (14) ✔ 20 138 3 0.0 0.000 0.686 (0;101) ✗ 02/02/17
Ca2Ni3Ge2 ICSD 421074 Pmma (51) ✔ 14 116 2 0.0 0.002 0.884 (1;100) ✗ 02/02/17
Ca2Ge ICSD 44854 Pnma (62) ✔ 12 96 1 0.3479 0.348 0.000 (0;000) ✗ 02/02/17
Ca2GePt2 COD 4002145 C2/c (15) ✔ 10 88 3 0.0 0.058 0.556 (0;000) ✗ 02/02/17
Ca2Hg ICSD 619362 Pnma (62) ✔ 12 128 1 0.0 0.034 0.604 (1;000) ✗ 02/02/17
Ca2HN ICSD 292 Fd-3m (227) ✔ 16 104 1 0.2723 0.278 0.000 (0;000) ✗ 02/02/17
NaCa2IO6 ICSD 425448 P2_1/c (14) ✔ 20 144 1 2.4371 2.611 0.000 (0;000) ✗ 02/02/17
Ca2In ICSD 413803 Pnma (62) ✔ 12 132 1 0.0 0.001 0.486 (0;011) ✗ 02/02/17
Ca2IN ICSD 65216 P6_3/mmc (194) ✔ 8 64 1 0.0 0.013 0.142 (1;000) ✗ 02/02/17
Ca2InOsO6 ICSD 190486 P2_1/c (14) ✔ 20 170 3 0.0 0.000 0.600 (0;010) ✗ 02/02/17
Ca2InPd2 ICSD 418202 C2/c (15) ✔ 10 138 3 0.0 0.000 0.480 (0;011) ✗ 02/02/17
Ca2InPt2 ICSD 418203 C2/c (15) ✔ 10 106 3 0.0 0.000 0.337 (0;011) ✗ 02/02/17
Ca2SiIr2 COD 1532211 C2/c (15) ✔ 10 116 3 0.0 0.096 0.412 (0;110) ✗ 02/02/17
Ca2MgWO6 COD 2013469 P2_1/c (14) ✔ 20 160 3 3.4238 3.484 0.000 (0;000) ✗ 02/02/17
Ca2Mn2O5 ICSD 35219 Pbam (55) ✔ 18 160 3 0.0 0.002 0.942 (0;100) ✗ 02/02/17
Ca2MnReO6 ICSD 247998 P2_1/c (14) ✔ 20 172 3 0.009 0.021 0.000 (1;010) ✗ 02/02/17
Ca2TaMnO6 ICSD 246091 P2_1/m (11) ✔ 20 168 3 0.0 0.006 0.468 (1;000) ✗ 02/02/17
Ca2MnWO6 ICSD 51615 P2_1/c (14) ✔ 20 170 3 0.0 0.000 0.904 (0;010) ✗ 02/02/17
RbCa2Nb3O10 ICSD 260289 P4/mmm (123) ✔ 16 128 2 1.8878 2.242 0.000 (0;000) ✗ 02/02/17
Ca2NiOsO6 ICSD 152444 P2_1/c (14) ✔ 20 164 3 0.0359 0.078 0.000 (0;000) ✗ 02/02/17
Ca2NiWO6 ICSD 155734 P2_1/c (14) ✔ 20 160 2 0.0 0.135 0.107 (0;000) ✗ 02/02/17
Ca2NiWO6 ICSD 160110 P2_1/c (14) ✔ 20 160 3 0.0 0.037 0.636 (0;000) ✗ 02/02/17
RbCa2Ta3O10 ICSD 89010 P4/mmm (123) ✔ 16 128 2 2.141 2.351 0.000 (0;000) ✗ 02/02/17
Ca2ScSbO6 ICSD 262995 P2_1/c (14) ✔ 20 144 3 3.8324 4.021 0.000 (0;000) ✗ 02/02/17
Ca2Pb ICSD 58920 Pnma (62) ✔ 12 136 1 0.0 0.069 0.004 (0;000) ✗ 02/02/17
Ca2Si ICSD 191034 Pnma (62) ✔ 12 96 1 0.3204 0.320 0.000 (0;000) ✗ 02/02/17
Ca2Sn ICSD 58935 Pnma (62) ✔ 12 136 1 0.1234 0.126 0.000 (0;000) ✗ 02/02/17
Ca3CrN3 COD 1005045 Cmcm (63) ✔ 14 118 1 0.0 0.000 0.509 (0;000) ✗ 02/02/17
Ca3Zn2(CuP2)2 ICSD 89515 P-3m1 (164) ✔ 11 96 2 0.0 0.092 0.010 (0;000) ✗ 02/02/17
Ca3(GaN2)2 COD 4323350 C2/c (15) ✔ 18 152 2 1.9889 1.989 0.000 (0;000) ✗ 02/02/17
Ca3(GaP2)2 ICSD 423781 C2/c (15) ✔ 18 152 2 1.0033 1.112 0.000 (0;000) ✗ 02/02/17
Ca3Ga5 ICSD 58894 Cmcm (63) ✔ 16 190 3 0.0 0.000 0.935 (0;110) ✗ 02/02/17
Ca3GeO ICSD 413383 Imma (74) ✔ 10 80 1 0.0 0.015 0.010 (0;000) ✗ 02/02/17
Ca3H2Pb ICSD 165616 Cmcm (63) ✔ 12 92 1 0.0 0.005 0.020 (0;000) ✗ 02/02/17
Ca3SnH2 ICSD 165615 Cmcm (63) ✔ 12 92 1 0.133 0.133 0.000 (0;000) ✗ 02/02/17
Ca3Hg2 ICSD 58904 P4/mbm (127) ✔ 10 108 1 0.0 0.006 0.759 (0;000) ✗ 02/02/17
Ca3MnN3 ICSD 67888 Cmcm (63) ✔ 14 120 1 0.0 0.012 0.594 (0;000) ✗ 02/02/17
Ca3N2 ICSD 162794 C2/m (12) ✔ 15 120 1 1.3801 1.440 0.000 (0;000) ✗ 02/02/17
Ca3VN3 COD 1005013 Cmcm (63) ✔ 14 116 1 0.6765 0.984 0.000 (0;000) ✗ 02/02/17
Ca3ReO6 ICSD 84791 P2_1/c (14) ✔ 20 162 1 0.0 0.000 0.860 (0;101) ✗ 02/02/17
Ca3TeO6 ICSD 16362 P2_1/c (14) ✔ 20 144 1 3.7915 4.049 0.000 (0;000) ✗ 02/02/17
Ca3WO6 ICSD 262323 P2_1/c (14) ✔ 20 160 1 3.2315 3.447 0.000 (0;000) ✗ 02/02/17
Ca3SiO ICSD 413382 Imma (74) ✔ 10 80 1 0.0436 0.044 0.000 (0;000) ✗ 02/02/17
Ca3Pd2 ICSD 619502 R-3 (148) ✔ 15 198 2 0.0 0.025 0.742 (0;000) ✗ 02/02/17
Ca3Pt2 ICSD 619512 R-3 (148) ✔ 15 150 3 0.0 0.072 0.621 (0;000) ✗ 02/02/17
Ca4TiN4 COD 1528590 P-1 (2) ✔ 18 144 1 1.5561 1.680 0.000 (0;000) ✗ 02/02/17
Ca5CdCu2 ICSD 423251 I4/mcm (140) ✔ 16 168 1 0.0 0.004 0.614 (0;001) ✗ 02/02/17
Ca5CuPb3 ICSD 240159 P-3c1 (165) ✔ 18 206 1 0.0 0.000 0.617 (1;000) ✗ 02/02/17
Ca5FePb3 ICSD 240158 P6_3/mcm (193) ✔ 18 200 1 0.0 0.005 0.383 (0;000) ✗ 02/02/17