≤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
Zr5Sb3P ICSD 648093 P6_3/mcm (193) ✔ 18 80 3 0.0 0.000 0.817 (0;000) ✗ 02/02/17
KP(HO2)2 ICSD 186817 C222_1 (20) ✗ 16 80 2 6.4968 6.643 0.000 (0;000) ✗ 15/02/17
RbP(HO2)2 ICSD 69317 I-42d (122) ✗ 16 80 3 5.5219 5.567 0.000 (0;000) ✗ 28/03/17
TlF ICSD 9873 Pma2 (28) ✗ 8 80 2 0.0 0.011 0.067 (1;000) ✔ 15/02/17
S3(NO)2 COD 7221393 C2/c (15) ✔ 14 80 1 1.241 1.348 0.000 (0;000) ✗ 02/02/17
Ag2O3 COD 1509692 Fdd2 (43) ✗ 10 80 3 0.4982 0.687 0.000 (0;000) ✔ 16/03/17
CoCuP2O7 ICSD 75379 P1 (1) ✗ 11 80 3 0.0 0.032 0.545 ? ✗ 15/02/17
N2 COD 9014232 Pmna (53) ✔ 16 80 1 0.0 0.002 0.369 (1;100) ✗ 02/02/17
SrTiS3 ICSD 651070 P6_3/mmc (194) ✔ 10 80 1 0.0 0.026 0.078 (0;000) ✗ 02/02/17
Na2ZrSe3 ICSD 412158 C2/m (12) ✔ 12 80 2 1.0681 1.371 0.000 (0;000) ✗ 02/02/17
RbP(HO2)2 ICSD 69318 Fdd2 (43) ✗ 16 80 1 0.0 0.027 0.134 (0;000) ✔ 29/03/17
H2C3O COD 2002929 P-1 (2) ✔ 24 80 1 1.6811 1.714 0.000 (0;000) ✗ 04/08/17
Rb3YF6 COD 1529659 I4/mmm (139) ✔ 10 80 1 4.4515 4.452 0.000 (0;000) ✗ 02/02/17
FeHgC4(SN)4 ICSD 87888 I-4 (82) ✗ 14 80 3 0.0 0.005 0.899 ? ✗ 21/03/17
Cs2ZrO3 ICSD 67345 Cmcm (63) ✔ 12 80 2 3.7167 3.717 0.000 (0;000) ✗ 02/02/17
Cs2SiS3 ICSD 409176 C2/m (12) ✔ 12 80 1 3.0578 3.089 0.000 (0;000) ✗ 02/02/17
ScPS4 ICSD 67559 P-1 (2) ✔ 12 80 2 1.8147 1.862 0.000 (0;000) ✗ 02/02/17
Li8SeN2 ICSD 247255 I4_1md (109) ✗ 22 80 1 1.648 1.648 0.000 (0;000) ✗ 04/08/17
KIO4 ICSD 26964 I4_1/a (88) ✔ 12 80 3 0.0835 0.084 0.000 (0;000) ✗ 02/02/17
RbP(HO2)2 ICSD 54873 Fdd2 (43) ✗ 16 80 3 0.0 0.006 0.019 (1;000) ✔ 28/03/17
Zr3Fe2Si3 ICSD 633671 Cmcm (63) ✔ 16 80 3 0.0 0.010 0.716 (1;110) ✗ 02/02/17
Cs2GeSe3 ICSD 415215 C2/m (12) ✔ 12 80 1 1.7854 1.887 0.000 (0;000) ✗ 02/02/17
RbIO4 COD 1521183 I4_1/a (88) ✔ 12 80 1 2.9615 2.980 0.000 (0;000) ✗ 02/02/17
Li2HIO ICSD 74930 Pnma (62) ✔ 20 80 1 4.1333 4.133 0.000 (0;000) ✗ 02/02/17
C5N4 ICSD 2130 R3c (161) ✗ 18 80 3 6.2909 6.303 0.000 (0;000) ✗ 21/03/17
RuO4 ICSD 415306 C2/c (15) ✔ 10 80 1 2.4051 2.469 0.000 (0;000) ✗ 04/08/17
CsTa(PO4)2 ICSD 20726 P-1 (2) ✔ 12 80 2 3.5265 3.612 0.000 (0;000) ✗ 02/02/17
CsNb(PO4)2 ICSD 88870 C2/m (12) ✔ 12 80 2 2.9869 3.070 0.000 (0;000) ✗ 02/02/17
BaAl2O4 COD 1010039 P6_322 (182) ✗ 14 80 3 3.8461 4.116 0.000 (0;000) ✗ 16/03/17
RbNiCl3 COD 1527092 P6_3/mmc (194) ✔ 10 80 1 0.0 0.003 0.206 (0;000) ✗ 02/02/17
SnSe COD 9008786 Pnma (62) ✔ 8 80 2 0.4969 0.652 0.000 (0;000) ✗ 02/02/17
PHF2 ICSD 406360 P2_12_12_1 (19) ✗ 16 80 1 3.7561 3.781 0.000 (0;000) ✗ 22/03/17
SrN6 ICSD 35226 Fddd (70) ✔ 14 80 1 3.6409 3.751 0.000 (0;000) ✗ 02/02/17
FeTe2 ICSD 633869 Pa3 (205) ✔ 12 80 3 0.0324 0.108 0.000 (0;000) ✗ 02/02/17
KAlSiO4 COD 9001818 P31c (159) ✗ 14 80 3 4.7088 4.709 0.000 (0;000) ✗ 16/03/17
KP(HO2)2 COD 9009237 Fdd2 (43) ✗ 16 80 3 0.0 0.003 0.163 (0;000) ✔ 28/03/17
Sb2Pt COD 9012348 Pa3 (205) ✔ 12 80 3 0.0 0.170 0.036 (0;000) ✗ 02/02/17
Br2O ICSD 50198 Pna2_1 (33) ✗ 12 80 2 1.0922 1.294 0.000 (0;000) ✗ 21/03/17
Ca ICSD 162254 P4_12_12 (92) ✗ 8 80 3 0.0 0.001 0.772 ? ✗ 15/02/17
Rb2GeS3 COD 8100500 C2/m (12) ✔ 12 80 1 2.3151 2.399 0.000 (0;000) ✗ 02/02/17
KAlSiO4 COD 9002252 P6_3 (173) ✗ 14 80 3 4.7175 4.777 0.000 (0;000) ✗ 16/03/17
Cs3YF6 COD 1529660 I4/mmm (139) ✔ 10 80 3 5.4624 5.462 0.000 (0;000) ✗ 02/02/17
WSe2 COD 9012193 P6_3/mmc (194) ✔ 6 80 2 0.8573 1.336 0.000 (0;000) ✗ 11/04/17
SbCl5 ICSD 412111 P6_3/mmc (194) ✔ 12 80 1 1.8539 1.854 0.000 (0;000) ✗ 02/02/17
CO ICSD 40937 R3c (161) ✗ 16 80 1 5.0941 5.145 0.000 (0;000) ✗ 22/03/17
H2C3S COD 2016192 P-1 (2) ✔ 24 80 1 0.0 0.081 0.158 (0;000) ✗ 04/08/17
Sr2I2O COD 8102957 Ibam (72) ✔ 10 80 1 3.1001 3.225 0.000 (0;000) ✗ 02/02/17
Ba(BS2)2 COD 1510637 Cc (9) ✗ 14 80 1 2.6688 2.785 0.000 (0;000) ✗ 21/03/17
Rb2SiS3 COD 8100236 C2/m (12) ✔ 12 80 1 2.8708 2.943 0.000 (0;000) ✗ 02/02/17
HNF2 ICSD 404200 Pca2_1 (29) ✗ 16 80 1 5.0387 5.072 0.000 (0;000) ✗ 15/02/17
WS2 COD 9009145 P6_3/mmc (194) ✔ 6 80 2 0.9842 1.553 0.000 (0;000) ✗ 11/04/17
GeTe ICSD 56604 Pbcn (60) ✔ 16 80 3 0.0 0.017 0.270 (1;000) ✗ 02/02/17
TePb ICSD 648609 Pnma (62) ✔ 8 80 2 0.0 0.146 0.014 (0;000) ✗ 02/02/17
CsP(HO2)2 ICSD 79609 P2_1/m (11) ✔ 16 80 1 5.2962 5.388 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
MgTiO3 COD 9010587 R-3 (148) ✔ 10 80 3 3.7492 3.814 0.000 (0;000) ✗ 04/08/17
Au2O3 COD 2105390 Fdd2 (43) ✗ 10 80 3 1.0569 1.226 0.000 (0;000) ✗ 15/02/17
Al4CO4 COD 2310612 Cmc2_1 (36) ✗ 18 80 3 3.8694 3.958 0.000 (0;000) ✗ 21/03/17
PbS COD 9014778 Pnma (62) ✔ 8 80 1 0.0 0.333 0.027 (0;000) ✗ 02/02/17
OsO4 ICSD 23803 C2/c (15) ✔ 10 80 1 3.023 3.060 0.000 (0;000) ✗ 04/08/17
Zr5Sb4 ICSD 153609 P6_3/mcm (193) ✔ 18 80 3 0.0 0.006 0.733 (0;000) ✗ 02/02/17
N2 ICSD 40936 R-3c (167) ✔ 16 80 1 5.8672 5.886 0.000 (0;000) ✗ 02/02/17
SeS2(NO)2 ICSD 69978 C2/c (15) ✔ 14 80 1 1.8532 1.897 0.000 (0;000) ✗ 02/02/17
CsMgI3 ICSD 87262 P6_3/mmc (194) ✔ 10 80 1 3.1028 3.128 0.000 (0;000) ✗ 02/02/17
BaSi6N8O ICSD 415272 Imm2 (44) ✗ 16 80 3 4.3246 4.411 0.000 (0;000) ✗ 15/02/17
GePdS3 ICSD 408505 C2/m (12) ✔ 10 80 1 1.1255 1.456 0.000 (0;000) ✗ 02/02/17
S3(NO)2 COD 7221380 C2/c (15) ✔ 14 80 1 1.5897 1.717 0.000 (0;000) ✗ 02/02/17
H4C3O4 COD 4507995 P-1 (2) ✔ 22 80 3 2.2883 2.328 0.000 (0;000) ✗ 04/08/17
Cs2NaYCl6 ICSD 245354 Fm-3m (225) ✔ 10 80 2 5.0966 5.097 0.000 (0;000) ✗ 02/02/17
Mg3P2 COD 1011277 Pn-3m (224) ✔ 10 80 1 1.0541 1.179 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
K2GeSe3 ICSD 300233 P-1 (2) ✔ 12 80 1 1.7432 1.819 0.000 (0;000) ✗ 02/02/17
KP(HO2)2 COD 1010458 I-42d (122) ✗ 16 80 3 5.5574 5.568 0.000 (0;000) ✗ 15/02/17
Cs2KYF6 ICSD 155977 Fm-3m (225) ✔ 10 80 1 6.8517 6.852 0.000 (0;000) ✗ 02/02/17
Na3Mo(OF)3 ICSD 97452 R3 (146) ✗ 10 80 1 3.9124 4.098 0.000 (0;000) ✗ 15/02/17
Na2CS3 ICSD 73094 C2/c (15) ✔ 12 80 1 1.1499 1.499 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
Zr3(Si3Cu2)2 ICSD 629244 I4/mmm (139) ✔ 13 80 3 0.0 0.000 0.843 (1;110) ✗ 22/03/17
SnO COD 1101035 Cmc2_1 (36) ✗ 8 80 2 0.0 0.009 0.349 (1;011) ✔ 15/02/17
Rb2GeSe3 ICSD 402719 C2/m (12) ✔ 12 80 1 0.8322 0.906 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
P2O5 ICSD 77377 Fdd2 (43) ✗ 14 80 3 5.886 5.886 0.000 (0;000) ✗ 15/02/17
SrGe(HO2)2 ICSD 30320 I-42d (122) ✗ 16 80 3 4.6209 4.716 0.000 (0;000) ✗ 15/02/17
HNF2 COD 9016159 Pmna (53) ✔ 16 80 1 0.0 0.002 0.279 (0;000) ✗ 02/02/17
Cs2KScCl6 ICSD 59196 Fm-3m (225) ✔ 10 80 3 3.2291 3.229 0.000 (0;000) ✗ 02/02/17
Li2RuO3 ICSD 202611 C2/m (12) ✔ 12 80 2 0.0 0.087 0.084 (0;001) ✗ 04/08/17
KIO4 COD 1010306 I4_1/a (88) ✔ 12 80 1 0.0 0.002 0.338 (1;111) ✗ 02/02/17
TlF ICSD 16112 Pma2 (28) ✗ 8 80 2 1.4283 1.431 0.000 (0;000) ✗ 06/10/16
Mg3As2 ICSD 24485 Pn-3m (224) ✔ 10 80 3 0.7835 0.869 0.000 (0;000) ✗ 06/10/16
Na2SiO3 ICSD 74640 Ccm2_1 (36) ✗ 12 80 1 4.2212 4.540 0.000 (0;000) ✗ 06/10/16
Zr(MoO4)2 COD 2103589 C2/m (12) ✔ 11 80 3 2.6175 2.799 0.000 (0;000) ✗ 27/01/17
Sr2NiWO6 ICSD 109165 Fm-3m (225) ✔ 10 80 3 0.0 0.000 0.368 (0;000) ✗ 27/01/17
CoAsS ICSD 31189 P2_1ca (29) ✗ 12 80 3 0.8804 1.143 0.000 (0;000) ✗ 06/10/16
LiCuO ICSD 188520 I-4m2 (119) ✗ 12 80 3 1.4772 1.679 0.000 (0;000) ✗ 07/10/16
Ti(CuS)4 ICSD 82558 I-42m (121) ✗ 9 80 3 1.4281 1.713 0.000 (0;000) ✗ 07/10/16
KH3F4 COD 4124451 R-3c (167) ✔ 16 80 1 6.4747 6.534 0.000 (0;000) ✗ 27/01/17
HfW2 ICSD 639012 Fd-3m (227) ✔ 6 80 3 0.0 0.000 0.639 (0;000) ✗ 27/01/17
CoAsS ICSD 41757 Pca2_1 (29) ✗ 12 80 3 0.9749 1.154 0.000 (0;000) ✗ 06/10/16
CoAsS ICSD 41758 Pca2_1 (29) ✗ 12 80 3 0.9695 1.147 0.000 (0;000) ✗ 06/10/16
CoAsS ICSD 41857 Pca2_1 (29) ✗ 12 80 3 0.0 0.001 0.519 ? ✗ 06/10/16