≤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
NClO6 ICSD 25817 C2/c (15) ✔ 16 96 1 2.1258 2.155 0.000 (0;000) ✗ 02/02/17
ReClO3 ICSD 416751 P2_1/c (14) ✔ 20 160 1 3.6638 3.734 0.000 (0;000) ✗ 02/02/17
Na2CS3 ICSD 73094 C2/c (15) ✔ 12 80 1 1.1499 1.499 0.000 (0;000) ✗ 02/02/17
CN COD 2310460 Pbca (61) ✔ 16 72 1 5.2499 5.250 0.000 (0;000) ✗ 02/02/17
Cs2CoS2 ICSD 67389 Ibam (72) ✔ 10 94 1 0.0 0.000 0.195 (0;000) ✗ 02/02/17
K2CoSe2 ICSD 67390 Ibam (72) ✔ 10 94 1 0.0 0.001 0.278 (0;000) ✗ 02/02/17
Na2CoS2 ICSD 67386 Ibam (72) ✔ 10 94 1 0.0 0.001 0.349 (0;000) ✗ 02/02/17
CoSO4 COD 2310569 P2_1/m (11) ✔ 12 94 1 0.0 0.001 0.773 (1;010) ✗ 02/02/17
Rb2CoSe2 ICSD 67391 Ibam (72) ✔ 10 94 1 0.0 0.001 0.180 (0;000) ✗ 02/02/17
Sr6Li2Cr2N8O ICSD 411983 P-1 (2) ✔ 19 140 1 1.7419 1.768 0.000 (0;000) ✗ 02/02/17
Na4CrO4 ICSD 62676 P-1 (2) ✔ 18 148 1 0.0 0.004 0.733 (1;010) ✗ 02/02/17
CrPb2 COD 4031247 C2/m (12) ✔ 6 84 1 0.0 0.007 0.581 (0;111) ✗ 02/02/17
Cs2KYF6 ICSD 155977 Fm-3m (225) ✔ 10 80 1 6.8517 6.852 0.000 (0;000) ✗ 02/02/17
Cs2K4Fe2O5 ICSD 65942 C2/m (12) ✔ 13 100 1 0.0 0.012 0.098 (0;000) ✗ 02/02/17
Cs2GeSe3 ICSD 415215 C2/m (12) ✔ 12 80 1 1.7854 1.887 0.000 (0;000) ✗ 02/02/17
Cs2Sn2Hg3S8 ICSD 85598 P-1 (2) ✔ 15 130 1 1.743 1.786 0.000 (0;000) ✗ 02/02/17
Cs2MnTe2 ICSD 65461 Ibam (72) ✔ 10 90 1 0.0 0.000 0.301 (1;001) ✗ 02/02/17
Cs2P3 ICSD 65185 Fmmm (69) ✔ 10 66 1 0.8432 0.843 0.000 (0;000) ✗ 02/02/17
Cs2PSe5 ICSD 418434 P-1 (2) ✔ 16 106 1 1.52 1.622 0.000 (0;000) ✗ 02/02/17
Cs2Te2Pt ICSD 627076 Immm (71) ✔ 5 40 1 0.7283 0.972 0.000 (0;000) ✗ 02/02/17
Cs2ZrSe3 COD 8101657 Cmcm (63) ✔ 12 80 1 1.2811 1.281 0.000 (0;000) ✗ 02/02/17
Cs2S COD 1525329 Pnma (62) ✔ 12 96 1 2.4068 2.446 0.000 (0;000) ✗ 02/02/17
Cs3H(SeO4)2 COD 2100808 C2/m (12) ✔ 14 88 1 4.4215 4.457 0.000 (0;000) ✗ 02/02/17
Tl2CS3 ICSD 420223 C2/c (15) ✔ 12 96 1 1.4572 1.600 0.000 (0;000) ✗ 02/02/17
CsCu2I3 ICSD 150305 Cmcm (63) ✔ 12 104 1 1.9026 1.903 0.000 (0;000) ✗ 02/02/17
CsOsNOF5 ICSD 166587 P2_1/m (11) ✔ 18 142 1 0.0 0.000 0.670 (0;000) ✗ 02/02/17
CsSb2F7 COD 4343796 C2/c (15) ✔ 20 136 1 4.3589 4.409 0.000 (0;000) ✗ 02/02/17
CsFeS2 ICSD 53234 Immm (71) ✔ 8 58 1 0.0 0.002 0.010 (0;111) ✗ 02/02/17
CsGaS3 ICSD 281723 P2_1/c (14) ✔ 20 160 1 2.6307 2.708 0.000 (0;000) ✗ 02/02/17
CsHSO4 ICSD 24377 P2_1/m (11) ✔ 14 80 1 5.8881 5.889 0.000 (0;000) ✗ 02/02/17
CsNiI3 ICSD 423830 P6_3/mmc (194) ✔ 10 80 1 0.0 0.017 0.383 (0;000) ✗ 02/02/17
CsTaI6 ICSD 418487 C2/c (15) ✔ 16 128 1 0.6727 0.680 0.000 (0;000) ✗ 02/02/17
CsMnSb ICSD 627027 P4/nmm (129) ✔ 6 58 1 0.0 0.000 0.782 (1;001) ✗ 02/02/17
CsPSO2 ICSD 20543 P-1 (2) ✔ 20 128 1 4.3524 4.352 0.000 (0;000) ✗ 02/02/17
CsRe COD 9015216 Pnma (62) ✔ 8 96 1 0.0 0.006 0.325 (0;000) ✗ 02/02/17
CsYZnTe3 COD 4312038 Cmcm (63) ✔ 12 100 1 1.1521 1.152 0.000 (0;000) ✗ 02/02/17
KCu3Te2 COD 1525201 C2/m (12) ✔ 12 108 1 0.3579 0.358 0.000 (0;000) ✗ 02/02/17
Sr2FeCuSO3 ICSD 84963 P4/nmm (129) ✔ 16 126 1 0.0 0.000 0.752 (1;001) ✗ 02/02/17
KHfCuS3 COD 8101656 Cmcm (63) ✔ 12 100 1 0.8118 0.821 0.000 (0;000) ✗ 02/02/17
Cu ICSD 150681 C2/m (12) ✔ 2 22 1 0.0 0.001 0.054 (1;011) ✗ 02/02/17
K2NbCuS4 ICSD 402422 Fddd (70) ✔ 16 132 1 2.0085 2.170 0.000 (0;000) ✗ 02/02/17
K2VCuSe4 ICSD 84303 Fddd (70) ✔ 16 132 1 0.9604 1.170 0.000 (0;000) ✗ 02/02/17
KCuPdSe5 COD 4313762 P2_1/m (11) ✔ 16 136 1 1.0951 1.137 0.000 (0;000) ✗ 02/02/17
CuO2 ICSD 157553 Cmcm (63) ✔ 6 46 1 0.0 0.000 0.943 (0;110) ✗ 02/02/17
Rb2VCuS4 ICSD 84302 Fddd (70) ✔ 16 132 1 1.2635 1.533 0.000 (0;000) ✗ 02/02/17
SrCu ICSD 629306 P6_3/mmc (194) ✔ 8 84 1 0.0 0.015 0.328 (1;000) ✗ 02/02/17
TlSb4F13 COD 5910319 I4/m (87) ✔ 18 124 1 2.0098 2.151 0.000 (0;000) ✗ 02/02/17
PHSF2 ICSD 63001 P2_1/c (14) ✔ 20 104 1 4.5103 4.510 0.000 (0;000) ✗ 02/02/17
IF3 ICSD 411036 Pnma (62) ✔ 16 112 1 2.2231 2.317 0.000 (0;000) ✗ 02/02/17
K2TeOF4 ICSD 412955 Cmcm (63) ✔ 16 116 1 5.1391 5.288 0.000 (0;000) ✗ 02/02/17
K2FeF5 COD 1513882 C2/m (12) ✔ 16 122 1 0.0 0.003 0.042 (0;111) ✗ 02/02/17
K2SbF5 ICSD 39630 Cmcm (63) ✔ 16 116 1 4.7652 4.832 0.000 (0;000) ✗ 02/02/17
K2HfF6 ICSD 29514 C2/c (15) ✔ 18 144 1 6.6195 6.713 0.000 (0;000) ✗ 02/02/17
Sb(IF3)2 ICSD 63301 P-1 (2) ✔ 18 122 1 0.5805 0.635 0.000 (0;000) ✗ 02/02/17
Na3MnF6 COD 4322721 P2_1/c (14) ✔ 20 168 1 0.0114 0.032 0.000 (0;000) ✗ 02/02/17
Na3VF6 ICSD 27347 P2_1/c (14) ✔ 20 164 1 0.0 0.003 0.034 (0;000) ✗ 02/02/17
Rb3TlF6 COD 1529657 I4/mmm (139) ✔ 10 82 1 2.5253 3.189 0.000 (0;000) ✗ 02/02/17
SrTaF7 ICSD 417254 P2_1/m (11) ✔ 18 144 1 5.7736 5.830 0.000 (0;000) ✗ 02/02/17
K3Na(FeO4)2 ICSD 159909 P-3m1 (164) ✔ 14 100 1 0.0 0.008 0.168 (0;001) ✗ 02/02/17
RbFe2Se3 ICSD 81547 Cmcm (63) ✔ 12 86 1 0.0 0.000 0.370 (0;000) ✗ 02/02/17
Sr8Fe3N8 ICSD 409949 C2/m (12) ✔ 19 144 1 0.0 0.000 0.933 (0;111) ✗ 02/02/17
KFeSe2 ICSD 40780 C2/c (15) ✔ 8 58 1 0.0 0.000 0.500 (1;101) ✗ 02/02/17
SiH3F ICSD 60065 P2_1/c (14) ✔ 20 56 1 6.3681 6.415 0.000 (0;000) ✗ 02/02/17
SNF ICSD 21015 R-3 (148) ✔ 18 108 1 4.1893 4.216 0.000 (0;000) ✗ 02/02/17
F2 COD 9012465 Pm-3n (223) ✔ 8 56 1 0.0 0.000 0.909 (1;000) ✗ 02/02/17
Ga2PdI8 ICSD 413230 C2/m (12) ✔ 11 100 1 1.1575 1.304 0.000 (0;000) ✗ 02/02/17
Sr(GaS2)2 ICSD 635274 Cccm (66) ✔ 14 120 1 2.7389 2.819 0.000 (0;000) ✗ 02/02/17
Sr2GaGeN ICSD 420413 P2_1/m (11) ✔ 10 84 1 0.0 0.566 0.036 (0;000) ✗ 02/02/17
LiGaI3 COD 1530097 P2_1/m (11) ✔ 20 148 1 2.2566 2.316 0.000 (0;000) ✗ 02/02/17
MgGa COD 1522869 I4_1/a (88) ✔ 16 184 1 0.0 0.002 0.338 (1;111) ✗ 02/02/17
TlGaSe2 COD 7221239 I4/mcm (140) ✔ 8 76 1 0.2788 0.280 0.000 (0;000) ✗ 02/02/17
K2Ge2Pb2O7 ICSD 30247 P-3 (147) ✔ 13 96 1 3.1033 3.303 0.000 (0;000) ✗ 02/02/17
SrGe3 COD 4343959 I4/mmm (139) ✔ 16 88 1 0.0 0.005 0.619 (0;000) ✗ 02/02/17
K4GeO4 ICSD 37271 P-1 (2) ✔ 18 128 1 2.9874 3.055 0.000 (0;000) ✗ 02/02/17
Sr2GeN2 ICSD 153302 Cmce (64) ✔ 20 136 1 0.0 0.015 0.033 (0;000) ✗ 02/02/17
Sr3GeO ICSD 413385 Pnma (62) ✔ 20 160 1 0.1546 0.155 0.000 (0;000) ✗ 02/02/17
Rb2GeSe3 ICSD 402719 C2/m (12) ✔ 12 80 1 0.8322 0.906 0.000 (0;000) ✗ 02/02/17
Sr2GeS4 ICSD 23420 P2_1/m (11) ✔ 14 96 1 2.4357 2.493 0.000 (0;000) ✗ 02/02/17
Sr2Ge COD 1520914 Pnma (62) ✔ 12 96 1 0.3586 0.359 0.000 (0;000) ✗ 02/02/17
NaH4IO2 COD 7202888 P-1 (2) ✔ 16 64 1 3.603 3.603 0.000 (0;000) ✗ 02/02/17
K4HgP2 ICSD 67263 R-3m (166) ✔ 7 58 1 1.021 1.064 0.000 (0;000) ✗ 02/02/17
Li3TeHO4 ICSD 38036 P2_1/m (11) ✔ 18 80 1 3.6746 3.978 0.000 (0;000) ✗ 02/02/17
SrI2 ICSD 203137 Pnma (62) ✔ 12 96 1 3.5183 3.518 0.000 (0;000) ✗ 02/02/17
SiI3 COD 2019712 R-3 (148) ✔ 8 50 1 2.7095 2.751 0.000 (0;000) ✗ 02/02/17
NbI5 COD 7221145 P-1 (2) ✔ 12 96 1 0.0 0.048 0.113 (0;111) ✗ 02/02/17
K2TeI6 ICSD 23649 P2_1/c (14) ✔ 18 132 1 1.4052 1.537 0.000 (0;000) ✗ 02/02/17
KIO4 COD 1010306 I4_1/a (88) ✔ 12 80 1 0.0 0.002 0.338 (1;111) ✗ 02/02/17
Zn(InS2)2 ICSD 42668 P-3m1 (164) ✔ 14 124 1 0.0 0.010 0.178 (0;001) ✗ 02/02/17
Sr5In3 ICSD 640583 I4/mcm (140) ✔ 16 178 1 0.0 0.004 0.654 (0;000) ✗ 02/02/17
K2NaInP2 ICSD 300132 Ibam (72) ✔ 12 100 1 1.1336 1.138 0.000 (0;000) ✗ 02/02/17
NaInTe2 ICSD 25346 I4/mcm (140) ✔ 8 68 1 0.7113 0.926 0.000 (0;000) ✗ 02/02/17
TlInS2 ICSD 600748 I4/mcm (140) ✔ 8 76 1 0.6757 0.676 0.000 (0;000) ✗ 02/02/17
Ir ICSD 201258 Pmma (51) ✔ 2 34 1 0.0 0.000 0.997 (0;000) ✗ 02/02/17
SbSI ICSD 28305 Pnma (62) ✔ 12 72 1 1.329 1.450 0.000 (0;000) ✗ 02/02/17
K2Mg5Sn3 ICSD 421342 I4/mmm (139) ✔ 10 110 1 0.0 0.014 0.150 (0;000) ✗ 02/02/17
K2MnSe2 ICSD 65456 Ibam (72) ✔ 10 90 1 0.0 0.000 0.274 (0;100) ✗ 02/02/17
K2Ni3S4 COD 1005023 Fddd (70) ✔ 18 144 1 0.7316 0.855 0.000 (0;000) ✗ 02/02/17
K2PbO2 ICSD 2266 P-1 (2) ✔ 20 176 1 1.8725 1.873 0.000 (0;000) ✗ 02/02/17
K2S2O5 COD 2310629 P2_1/m (11) ✔ 18 120 1 3.6861 3.745 0.000 (0;000) ✗ 02/02/17
K2ZnTe2 ICSD 420088 Ibam (72) ✔ 10 84 1 1.8566 1.935 0.000 (0;000) ✗ 02/02/17