≤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
CdH6C2I2(NO)2 ICSD 192774 P-1 (2) ✔ 15 62 1 2.8954 2.929 0.000 (0;000) ✗ 02/02/17
H6C2SeO COD 2015142 P-1 (2) ✔ 20 52 1 4.0465 4.129 0.000 (0;000) ✗ 02/02/17
KHgC2IN2 ICSD 18198 Cmcm (63) ✔ 14 92 1 2.5564 2.847 0.000 (0;000) ✗ 02/02/17
HgC2(NO)2 ICSD 245329 Cmce (64) ✔ 14 84 2 3.7029 3.807 0.000 (0;000) ✗ 02/02/17
HgC2(SeN)2 ICSD 85760 P2_1/c (14) ✔ 14 84 2 2.326 2.434 0.000 (0;000) ✗ 02/02/17
RbC2I3N2 ICSD 35411 Pmmn (59) ✔ 16 96 1 2.5739 2.800 0.000 (0;000) ✗ 02/02/17
BaF2 COD 9009004 Fm-3m (225) ✔ 3 24 1 6.7708 6.829 0.000 (0;000) ✗ 05/01/17
PbC2(SN)2 ICSD 143 C2/c (15) ✔ 14 88 1 2.2153 2.282 0.000 (0;000) ✗ 02/02/17
SnC2(SN)2 ICSD 201193 P-1 (2) ✔ 14 88 1 2.4482 2.511 0.000 (0;000) ✗ 02/02/17
SrC2(SN)2 ICSD 94427 C2/c (15) ✔ 14 80 1 3.9047 3.934 0.000 (0;000) ✗ 02/02/17
C2SeN2 ICSD 173995 Cmce (64) ✔ 20 96 1 0.0 0.137 0.007 (0;000) ✗ 02/02/17
C2N3 COD 4029897 Cmce (64) ✔ 20 92 1 1.3238 1.324 0.000 (0;000) ✗ 02/02/17
Si(CN2)2 COD 1526364 Pn-3m (224) ✔ 14 64 3 4.2091 4.209 0.000 (0;000) ✗ 02/02/17
Na(CO)2 ICSD 154355 P2_1/c (14) ✔ 20 116 1 2.5928 2.593 0.000 (0;000) ✗ 02/02/17
C2S2O COD 2008373 P2_1/c (14) ✔ 20 104 2 2.5413 2.574 0.000 (0;000) ✗ 02/02/17
Pb(CS)2 COD 4107278 P6/mmm (191) ✔ 15 102 3 0.7085 0.710 0.000 (0;000) ✗ 02/02/17
BaLiF3 ICSD 45310 Pm-3m (221) ✔ 5 34 1 6.6401 6.640 0.000 (0;000) ✗ 05/01/17
BaGeF6 COD 1010206 R-3m (166) ✔ 8 56 1 6.4215 6.422 0.000 (0;000) ✗ 05/01/17
Ba3Ir(CN)3 ICSD 424762 P6_3/m (176) ✔ 20 148 1 0.6652 1.246 0.000 (0;000) ✗ 02/02/17
KBC3N3F ICSD 412871 P-1 (2) ✔ 18 92 1 5.968 6.072 0.000 (0;000) ✗ 02/02/17
RuC3Br2O3 ICSD 48158 C2/m (12) ✔ 18 120 1 2.0975 2.155 0.000 (0;000) ✗ 02/02/17
Ca3C3Cl2 ICSD 33818 Cmcm (63) ✔ 16 112 1 1.2545 1.336 0.000 (0;000) ✗ 02/02/17
Sr3Co(CN)3 ICSD 423302 P6_3/m (176) ✔ 20 148 1 1.2302 1.634 0.000 (0;000) ✗ 02/02/17
CsMn(CN)3 COD 4314775 Fm-3m (225) ✔ 16 102 3 0.0 0.016 0.649 (0;000) ✗ 02/02/17
CsC3(SeN)3 ICSD 4101 C2/c (15) ✔ 20 108 1 1.9235 2.016 0.000 (0;000) ✗ 02/02/17
BaNiF6 ICSD 35396 R-3m (166) ✔ 8 62 1 1.4123 1.426 0.000 (0;000) ✗ 05/01/17
MgH4(ClO5)2 COD 2104833 C2/m (12) ✔ 17 88 2 3.083 3.109 0.000 (0;000) ✗ 27/01/17
H4C3N2Cl COD 2005472 C2/m (12) ✔ 20 66 1 2.2005 2.250 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
OsC3I2O3 ICSD 68901 C2/m (12) ✔ 18 120 1 1.7617 1.846 0.000 (0;000) ✗ 02/02/17
Hf2Al3C4 ICSD 161588 P6_3/mmc (194) ✔ 18 98 3 0.0 0.000 0.988 (0;000) ✗ 02/02/17
As2Se3 ICSD 611373 C2/m (12) ✔ 10 56 1 0.5143 0.533 0.000 (0;000) ✗ 30/01/17
KBa4Au(CO)4 COD 2002878 I4/mmm (139) ✔ 14 100 2 2.399 2.399 0.000 (0;000) ✗ 02/02/17
Ba(CO)4 ICSD 412830 I4/mcm (140) ✔ 18 100 1 2.5686 2.652 0.000 (0;000) ✗ 02/02/17
CsB(CN)4 COD 4308582 I4_1/a (88) ✔ 20 96 1 6.6641 6.715 0.000 (0;000) ✗ 02/02/17
KB(CN)4 ICSD 411180 I4_1/a (88) ✔ 20 96 1 6.4334 6.461 0.000 (0;000) ✗ 02/02/17
NaB(CN)4 COD 4308585 Fd-3m (227) ✔ 20 96 1 6.8589 6.878 0.000 (0;000) ✗ 02/02/17
RbB(CN)4 COD 4308589 I4_1/a (88) ✔ 20 96 1 6.58 6.604 0.000 (0;000) ✗ 02/02/17
TlB(CN)4 COD 4308590 I4_1/a (88) ✔ 20 104 1 5.027 5.031 0.000 (0;000) ✗ 02/02/17
Ca(CO)4 ICSD 248078 I4_1/amd (141) ✔ 18 100 1 4.1602 4.205 0.000 (0;000) ✗ 02/02/17
ZrC ICSD 183162 F-43m (216) ✗ 2 16 3 0.3943 0.467 0.000 (0;000) ✔ 06/10/16
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
Cu2GeS3 ICSD 85138 Cc (9) ✗ 12 88 3 0.3087 0.312 0.000 (0;000) ✔ 05/12/16
H2C5SN COD 7200215 P-1 (2) ✔ 18 66 1 1.9486 2.273 0.000 (0;000) ✗ 02/02/17
BaPbF6 ICSD 25521 R-3m (166) ✔ 8 66 1 3.4266 3.427 0.000 (0;000) ✗ 05/01/17
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
BaSiF6 COD 1530106 R-3m (166) ✔ 8 56 1 7.8259 7.826 0.000 (0;000) ✗ 05/01/17
Ca2FeClO3 ICSD 56880 P4/nmm (129) ✔ 14 106 1 0.0 0.000 0.751 (0;000) ✗ 02/02/17
BaSnF6 ICSD 33788 R-3 (148) ✔ 8 66 1 5.7036 5.704 0.000 (0;000) ✗ 05/01/17
BaTiF6 ICSD 33789 R-3m (166) ✔ 8 64 1 4.8484 4.971 0.000 (0;000) ✗ 05/01/17
CsCa2Ta3O10 ICSD 89011 P4/mmm (123) ✔ 16 128 2 2.3868 2.700 0.000 (0;000) ✗ 02/02/17
Cu2GeSe3 ICSD 192171 Cc (9) ✗ 12 88 3 0.0 0.089 0.019 (0;000) ✔ 06/10/16
BaFe2(PO4)2 ICSD 424895 R-3 (148) ✔ 13 84 2 0.1447 0.225 0.000 (0;000) ✗ 05/01/17
Cu2GeSe3 ICSD 70056 Im2m (44) ✗ 6 44 3 0.0 0.017 0.159 (0;000) ✔ 06/10/16
Ca2Zn2CuP3 ICSD 89517 P6_3/mmc (194) ✔ 16 140 2 0.2555 0.326 0.000 (0;000) ✗ 02/02/17
ZnNi ICSD 105472 F-43m (216) ✗ 2 22 3 0.0 0.043 0.357 (0;000) ✔ 06/10/16
Ca2FeMoO6 ICSD 89956 P2_1/c (14) ✔ 20 156 3 0.2263 0.298 0.000 (0;000) ✗ 02/02/17
BaMnSbF ICSD 248366 P4/nmm (129) ✔ 8 74 1 0.0 0.000 0.872 (0;000) ✗ 05/01/17
BaZnPF COD 7203812 P4/nmm (129) ✔ 8 68 1 0.416 0.416 0.000 (0;000) ✗ 05/01/17
YGe3 ICSD 88075 Cmcm (63) ✔ 8 46 3 0.0 0.000 0.736 (0;000) ✗ 27/01/17
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
BaZnSbF COD 7203813 P4/nmm (129) ✔ 8 68 1 0.0 0.028 0.046 (0;000) ✗ 05/01/17
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
SiCu2S3 ICSD 70057 Cmc2_1 (36) ✗ 12 88 3 1.3178 1.369 0.000 (0;000) ✗ 06/10/16
BaLi2(MgGe)2 COD 8101153 R-3m (166) ✔ 7 44 1 0.0 0.117 0.220 (0;000) ✗ 05/01/17
BaC2 ICSD 88102 C2/c (15) ✔ 6 36 1 1.9008 2.015 0.000 (0;000) ✗ 27/01/17