≤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
VBiO4 COD 9000051 Pbcn (60) ✔ 24 208 3 0.0 0.003 0.215 (1;000) ✗ 04/08/17
VBiO4 COD 9014682 Pbcn (60) ✔ 24 208 3 2.3177 2.414 0.000 (0;000) ✗ 04/08/17
Li2BPd3 COD 1511224 P4_332 (212) ✗ 24 252 3 0.0 0.000 0.557 ? ✗ 04/08/17
Li2BPt3 COD 1511225 P4_332 (212) ✗ 24 156 3 0.0 0.000 0.530 ? ✗ 04/08/17
Na3BP2 COD 8103467 P2_1/c (14) ✔ 24 160 1 1.861 2.075 0.000 (0;000) ✗ 04/08/17
NaBO2 COD 9015516 R-3c (167) ✔ 24 144 1 3.7128 3.713 0.000 (0;000) ✗ 04/08/17
TlBr2 COD 1527495 Pnna (52) ✔ 24 216 1 2.2705 2.271 0.000 (0;000) ✗ 04/08/17
KInBr4 COD 1004072 Pnna (52) ✔ 24 200 1 2.8711 2.871 0.000 (0;000) ✗ 04/08/17
PBr5 COD 1528267 Pbcm (57) ✔ 24 160 1 2.1153 2.243 0.000 (0;000) ✗ 04/08/17
K2SnBr6 COD 1010449 P42_12 (90) ✗ 18 148 3 0.0 0.005 0.146 ? ✗ 04/08/17
Te2Br COD 1527657 Pnma (62) ✔ 24 152 1 0.0 0.462 0.060 (0;000) ✗ 04/08/17
TlBS2 COD 4027829 R-3m (166) ✔ 24 168 2 0.0 0.038 1.000 (1;011) ✗ 04/08/17
H3C2N COD 2103498 P2_1/c (14) ✔ 24 64 1 7.2294 7.259 0.000 (0;000) ✗ 04/08/17
H3C2N COD 5000306 P-1 (2) ✔ 24 64 1 3.0551 3.102 0.000 (0;000) ✗ 04/08/17
HC2F COD 4116822 C2/c (15) ✔ 24 96 1 4.5863 4.606 0.000 (0;000) ✗ 04/08/17
NaC2N3 COD 4300181 Pnma (62) ✔ 24 128 1 4.1109 4.141 0.000 (0;000) ✗ 04/08/17
C3Cl2O COD 7202469 P2_1/c (14) ✔ 24 128 1 1.4252 1.472 0.000 (0;000) ✗ 04/08/17
C3IF2 COD 7208556 P2_1/c (14) ✔ 24 132 1 2.7461 2.746 0.000 (0;000) ✗ 04/08/17
H2C3O COD 2002929 P-1 (2) ✔ 24 80 1 1.6811 1.714 0.000 (0;000) ✗ 04/08/17
H2C3S COD 2016192 P-1 (2) ✔ 24 80 1 0.0 0.081 0.158 (0;000) ✗ 04/08/17
H4C3O4 COD 4507995 P-1 (2) ✔ 22 80 3 2.2883 2.328 0.000 (0;000) ✗ 04/08/17
H5(CO)3 COD 2008148 C2 (5) ✗ 22 70 1 4.3743 4.379 0.000 (0;000) ✗ 04/08/17
H2C4O5 COD 2102818 C2/c (15) ✔ 22 96 1 0.0 0.003 0.172 (0;000) ✗ 04/08/17
H3C4O5 COD 5000188 Cc (9) ✗ 24 98 1 4.4946 0.001 1.000 (0;000) ✗ 04/08/17
H5C4N3 COD 2207775 C2/c (15) ✔ 24 72 1 2.9527 2.971 0.000 (0;000) ✗ 04/08/17
H5(C2O)2 COD 4113700 P-1 (2) ✔ 22 66 1 2.6956 2.724 0.000 (0;000) ✗ 04/08/17
C4S3N5 COD 4116668 P-1 (2) ✔ 24 118 1 0.0 0.002 0.875 (0;010) ✗ 04/08/17
C5NCl5 COD 7221875 Pc (7) ✗ 22 120 1 3.4089 3.409 0.000 (0;000) ✗ 04/08/17
H12C5O4 COD 2101361 I-4 (82) ✗ 21 56 1 5.6597 5.684 0.000 (0;000) ✗ 04/08/17
H5C5N2 COD 2203306 P-1 (2) ✔ 24 70 1 2.377 2.436 0.000 (0;000) ✗ 04/08/17
H10C9O4 COD 2229064 P1 (1) ✗ 23 70 1 3.3437 3.523 0.000 (0;000) ✗ 04/08/17
Ca2Fe9O13 COD 1524840 C2/m (12) ✔ 24 170 3 0.0 0.006 0.586 (1;111) ✗ 04/08/17
Ca7Ni4Sn13 COD 1528162 P4/m (83) ✔ 24 292 3 0.0 0.003 0.911 (1;110) ✗ 04/08/17
CaMnF5 COD 1518174 C2/c (15) ✔ 14 120 1 0.0 0.002 0.361 (0;000) ✗ 04/08/17
CaSO4 COD 9003568 P2_1/c (14) ✔ 24 160 1 6.4075 6.633 0.000 (0;000) ✗ 04/08/17
CaSO4 COD 9003569 Pnma (62) ✔ 24 160 1 6.7502 6.838 0.000 (0;000) ✗ 04/08/17
Cs2CO3 COD 1527331 P2_1/c (14) ✔ 24 160 3 3.4916 3.511 0.000 (0;000) ✗ 04/08/17
Cd2P2O7 COD 2208748 P-1 (2) ✔ 22 152 3 2.9988 3.347 0.000 (0;000) ✗ 04/08/17
CdP2 COD 1528584 P4_32_12 (96) ✗ 24 176 3 1.1046 1.251 0.000 (0;000) ✗ 04/08/17
Fe3C COD 5910001 P-1 (2) ✔ 16 112 3 0.0 0.012 0.187 (1;011) ✗ 04/08/17
H4CN COD 2100665 P2_1/c (14) ✔ 24 52 1 4.7319 4.878 0.000 (0;000) ✗ 04/08/17
H4CN COD 2100668 P2_1/c (14) ✔ 24 52 1 4.4325 4.433 0.000 (0;000) ✗ 04/08/17
HC COD 4501704 P2_1/c (14) ✔ 24 60 1 4.4352 4.498 0.000 (0;000) ✗ 04/08/17
HCO COD 7100673 Pc (7) ✗ 24 88 1 3.0002 3.069 0.000 (0;000) ✗ 04/08/17
K2CO3 COD 9009645 P2_1/c (14) ✔ 24 160 1 3.9261 3.926 0.000 (0;000) ✗ 04/08/17
Pb7(ClF6)2 COD 1523195 P-6 (174) ✗ 21 196 3 3.7981 3.847 0.000 (0;000) ✗ 04/08/17
CuCl3O2 COD 2310504 P2_1/c (14) ✔ 24 176 1 0.006 0.082 1.000 (0;000) ✗ 04/08/17
RbCuCl3 COD 1527259 C2 (5) ✗ 20 164 1 0.0 0.024 0.396 ? ✗ 04/08/17
Ga2HCl3 COD 4320174 P2_1/c (14) ✔ 24 192 1 3.9594 3.964 0.000 (0;000) ✗ 04/08/17
Ga2CuCl8 COD 1530952 P2_1/c (14) ✔ 22 186 2 0.0 0.000 0.665 (0;010) ✗ 04/08/17