≤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
Tl5Se2Br ICSD 75960 I4/mcm (140) ✔ 16 168 3 0.1085 0.117 0.000 (0;000) ✗ 02/02/17
SeBr ICSD 37017 P2_1/c (14) ✔ 16 104 1 1.7231 1.861 0.000 (0;000) ✗ 02/02/17
SbSBr COD 1521208 Pnma (62) ✔ 12 72 1 1.6118 1.785 0.000 (0;000) ✗ 02/02/17
Tl5Te2Br ICSD 427679 I4/mcm (140) ✔ 16 168 3 0.0633 0.064 0.000 (0;000) ✗ 02/02/17
TaBRu ICSD 429116 Pmma (51) ✔ 18 192 3 0.0 0.012 0.833 (1;010) ✗ 02/02/17
Tl3BS3 COD 1511323 P2_1/m (11) ✔ 14 120 3 0.9641 1.129 0.000 (0;000) ✗ 02/02/17
TlBS3 COD 1511322 P2_1/c (14) ✔ 20 136 1 1.5675 1.727 0.000 (0;000) ✗ 02/02/17
Tl3BSe3 COD 1511327 P2_1/m (11) ✔ 14 120 1 0.7064 0.794 0.000 (0;000) ✗ 02/02/17
Zr5Sn3B ICSD 656289 P6_3/mcm (193) ✔ 18 130 3 0.0 0.000 0.765 (1;000) ✗ 02/02/17
CsAgC2 ICSD 410873 P4_2/mmc (131) ✔ 8 56 2 2.4888 2.489 0.000 (0;000) ✗ 02/02/17
NaAg(CN)2 ICSD 65697 C2/c (15) ✔ 12 76 1 2.7425 2.854 0.000 (0;000) ✗ 02/02/17
BaCa(CO3)2 COD 9013465 P2_1/m (11) ✔ 20 128 1 4.8058 4.848 0.000 (0;000) ✗ 02/02/17
BaMg(CO2)2 ICSD 193061 C2/m (12) ✔ 8 52 1 1.5397 1.540 0.000 (0;000) ✗ 02/02/17
BaMg(CO3)2 ICSD 193059 R-3m (166) ✔ 10 64 2 4.141 4.238 0.000 (0;000) ✗ 02/02/17
BaC2(SN)2 ICSD 94428 C2/c (15) ✔ 14 80 1 0.023 0.051 0.000 (0;000) ✗ 02/02/17
LiBC2(O2F)2 ICSD 185384 Cmcm (63) ✔ 20 104 1 3.7651 3.918 0.000 (0;000) ✗ 02/02/17
CsNiC2BrN2 ICSD 380468 I4/mmm (139) ✔ 14 88 3 0.0 0.012 0.283 (0;000) ✗ 02/02/17
RbNiC2BrN2 ICSD 380470 I4/mmm (139) ✔ 14 88 3 0.0 0.009 0.315 (0;000) ✗ 02/02/17
CaC2(SN)2 ICSD 412783 C2/c (15) ✔ 14 80 1 3.566 3.648 0.000 (0;000) ✗ 02/02/17
PC2N3Cl4 ICSD 81344 Cmcm (63) ✔ 20 112 1 3.7138 3.728 0.000 (0;000) ✗ 02/02/17
CsNiC2N2Cl ICSD 380469 I4/mmm (139) ✔ 14 88 2 0.0 0.009 0.271 (0;000) ✗ 02/02/17
RbNiC2N2Cl ICSD 380471 I4/mmm (139) ✔ 14 88 3 0.0 0.006 0.273 (0;000) ✗ 02/02/17
CsC2I3N2 ICSD 32521 Pmmn (59) ✔ 16 96 1 3.0749 3.166 0.000 (0;000) ✗ 02/02/17
CsKC2 ICSD 189822 Pnma (62) ✔ 16 104 1 3.2247 3.231 0.000 (0;000) ✗ 02/02/17
CsC2N5 COD 4320904 C2/c (15) ✔ 16 84 1 4.5738 4.606 0.000 (0;000) ✗ 02/02/17
CsNaC2 ICSD 189824 Pbcm (57) ✔ 16 104 1 3.1107 3.210 0.000 (0;000) ✗ 02/02/17
CsRbC2 ICSD 189823 Pnma (62) ✔ 16 104 1 2.8694 3.018 0.000 (0;000) ✗ 02/02/17
RbCuC2 ICSD 412039 P4_2/mmc (131) ✔ 8 56 2 2.067 2.067 0.000 (0;000) ✗ 02/02/17
P(CF3)2 COD 4321851 P-1 (2) ✔ 18 110 1 4.1715 4.308 0.000 (0;000) ✗ 02/02/17
BaH2C2O5 ICSD 151115 C2/m (12) ✔ 20 100 1 3.1951 3.297 0.000 (0;000) ✗ 02/02/17
HgH2C2I2N COD 2203720 P-1 (2) ✔ 16 82 3 2.1095 2.167 0.000 (0;000) ✗ 02/02/17
H2C2I COD 4508289 P-1 (2) ✔ 20 68 1 2.6863 2.762 0.000 (0;000) ✗ 02/02/17
H2C2O COD 7054714 P-1 (2) ✔ 20 64 1 3.9925 4.100 0.000 (0;000) ✗ 02/02/17
KH3C2O3 ICSD 77115 P-1 (2) ✔ 18 76 1 5.372 5.405 0.000 (0;000) ✗ 02/02/17
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
YMoC2 ICSD 618370 Pnma (62) ✔ 16 132 3 0.0 0.000 0.492 (0;011) ✗ 02/02/17
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
Y2ReC2 ICSD 69098 Pnma (62) ✔ 20 180 3 0.0 0.001 0.456 (1;011) ✗ 02/02/17
C2S3 COD 7006523 P2_1/c (14) ✔ 20 104 1 1.647 1.649 0.000 (0;000) ✗ 02/02/17
Y3AlC3 COD 4341867 Pmma (51) ✔ 14 96 3 0.0 0.007 0.468 (0;101) ✗ 02/02/17
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
PH2C3 COD 4323537 Cmcm (63) ✔ 12 38 1 0.0 0.000 0.807 (1;000) ✗ 02/02/17
H2C3S COD 4323536 Cmcm (63) ✔ 12 40 1 0.0 0.002 0.627 (1;110) ✗ 02/02/17
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
Zr2Al3C4 ICSD 159411 P6_3/mmc (194) ✔ 18 66 3 0.0 0.000 0.988 (1;000) ✗ 02/02/17
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
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