▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
ScPRu | ICSD | 77790 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.650 | ? | ✗ | 06/10/16 |
Zr2SbP | ICSD | 77797 | P6_3/mmc (194) | ✔ | 8 | 36 | 3 | 0.0 | 0.016 | 0.417 | (0;000) | ✗ | 27/01/17 |
LaS | ICSD | 77831 | Ccme (64) | ✔ | 8 | 36 | 2 | 0.0 | 0.000 | 0.635 | (1;000) | ✗ | 06/10/16 |
VS2 | ICSD | 77832 | Ccmm (63) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 1.000 | (1;000) | ✗ | 06/10/16 |
YP | ICSD | 77857 | Fm-3m (225) | ✔ | 2 | 16 | 3 | 0.0 | 0.189 | 0.173 | (0;000) | ✗ | 27/01/17 |
ZrP | ICSD | 77860 | P6_3/mmc (194) | ✔ | 8 | 36 | 3 | 0.0 | 0.011 | 0.588 | (0;000) | ✗ | 27/01/17 |
PbS | ICSD | 77865 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.271 | 0.306 | (1;111) | ✗ | 27/01/17 |
PbSe | ICSD | 77870 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.384 | 0.336 | (1;111) | ✗ | 27/01/17 |
TePb | ICSD | 77882 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.059 | 0.517 | (1;111) | ✗ | 27/01/17 |
PdSe | ICSD | 77895 | P4_2/m (84) | ✔ | 16 | 192 | 3 | 0.0 | 0.017 | 0.120 | (0;000) | ✗ | 02/02/17 |
CIN | ICSD | 77911 | R3m (160) | ✗ | 3 | 16 | 1 | 3.8512 | 3.926 | 0.000 | (0;000) | ✗ | 06/10/16 |
KAlF4 | ICSD | 77913 | P4/mmm (123) | ✔ | 6 | 40 | 2 | 7.3093 | 7.704 | 0.000 | (0;000) | ✗ | 05/01/17 |
ScSbPt | ICSD | 77948 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.5411 | 0.771 | 0.000 | (0;000) | ✗ | 15/02/17 |
Ni5Ge3 | ICSD | 77958 | C2 (5) | ✗ | 16 | 124 | 3 | 0.0 | 0.009 | 0.546 | ? | ✗ | 15/02/17 |
GePt3 | ICSD | 77962 | I4/mcm (140) | ✔ | 8 | 68 | 3 | 0.0 | 0.002 | 0.133 | (0;000) | ✗ | 27/01/17 |
SiPt2 | ICSD | 77973 | I4/mmm (139) | ✔ | 3 | 24 | 3 | 0.0 | 0.138 | 0.700 | (0;000) | ✗ | 27/01/17 |
Si3Pt2 | ICSD | 77974 | P6_3/mmc (194) | ✔ | 10 | 64 | 3 | 0.0 | 0.012 | 0.767 | (1;000) | ✗ | 27/01/17 |
SiPt3 | ICSD | 77975 | Pnma (62) | ✔ | 16 | 136 | 3 | 0.0 | 0.014 | 0.201 | (0;000) | ✗ | 02/02/17 |
Si5Pt12 | ICSD | 77977 | I4/m (87) | ✔ | 17 | 140 | 3 | 0.0 | 0.006 | 0.679 | (1;111) | ✗ | 02/02/17 |
Te4Pt3 | ICSD | 77983 | C2/m (12) | ✔ | 7 | 54 | 3 | 0.0 | 0.070 | 0.458 | (1;001) | ✔ | 27/01/17 |
Rb3Sb | ICSD | 77991 | P6_3/mmc (194) | ✔ | 8 | 64 | 1 | 0.1219 | 0.176 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrMnTlF7 | ICSD | 78041 | P2_1/m (11) | ✔ | 20 | 162 | 3 | 0.0 | 0.000 | 0.722 | (1;001) | ✗ | 02/02/17 |
RbZrMnF7 | ICSD | 78042 | P2_1/m (11) | ✔ | 20 | 154 | 3 | 0.0 | 0.000 | 0.863 | (1;000) | ✗ | 02/02/17 |
ReF7 | ICSD | 78311 | P-1 (2) | ✔ | 16 | 128 | 1 | 2.1498 | 2.170 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ga2TeO6 | ICSD | 78346 | P4_2/mnm (136) | ✔ | 18 | 136 | 3 | 1.3627 | 1.363 | 0.000 | (0;000) | ✗ | 27/01/17 |
Nb(Te2I3)2 | ICSD | 78371 | P-1 (2) | ✔ | 22 | 158 | 1 | 0.5229 | 0.606 | 0.000 | (0;000) | ✗ | 07/08/17 |
KSeO2F | ICSD | 78398 | P2_1/m (11) | ✔ | 10 | 68 | 1 | 3.8904 | 3.918 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba2CaTl2(CuO4)2 | ICSD | 78593 | I4/mmm (139) | ✔ | 15 | 126 | 3 | 0.0 | 0.007 | 0.975 | (0;000) | ✗ | 21/03/17 |
Sr2FeWO6 | ICSD | 78678 | Fm-3m (225) | ✔ | 10 | 78 | 3 | 0.5396 | 0.540 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li2RuO3 | ICSD | 78721 | C2/c (15) | ✔ | 24 | 160 | 3 | 0.0 | 0.008 | 0.292 | (1;000) | ✗ | 04/08/17 |
K2HBrO | ICSD | 78734 | P2_1/m (11) | ✔ | 10 | 64 | 1 | 3.7379 | 3.738 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2HBrO | ICSD | 78735 | P2_1/m (11) | ✔ | 10 | 64 | 1 | 3.6511 | 3.671 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiGaPdF6 | ICSD | 78748 | P-31c (163) | ✔ | 18 | 152 | 3 | 0.0 | 0.005 | 0.096 | (0;000) | ✗ | 02/02/17 |
CsNaTiO3 | ICSD | 78752 | Cmcm (63) | ✔ | 12 | 96 | 3 | 3.5344 | 3.588 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbNaTiO3 | ICSD | 78753 | C2/c (15) | ✔ | 12 | 96 | 1 | 3.7013 | 3.738 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr(CuAs)2 | ICSD | 78756 | I4/mmm (139) | ✔ | 5 | 42 | 3 | 0.0 | 0.055 | 0.314 | (1;111) | ✗ | 05/01/17 |
CrF4 | ICSD | 78778 | P4_2/mnm (136) | ✔ | 20 | 168 | 2 | 0.0 | 0.023 | 0.922 | (0;000) | ✗ | 02/02/17 |
TlPt2S3 | ICSD | 78784 | P-3m1 (164) | ✔ | 12 | 102 | 2 | 0.7331 | 0.783 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlPt2Se3 | ICSD | 78785 | P-3m1 (164) | ✔ | 12 | 102 | 3 | 0.0 | 0.447 | 0.035 | (0;000) | ✗ | 02/02/17 |
TlPd2Se3 | ICSD | 78786 | P-3m1 (164) | ✔ | 12 | 134 | 3 | 0.0 | 0.223 | 0.134 | (0;000) | ✗ | 02/02/17 |
TlTe3Pt2 | ICSD | 78787 | P-3m1 (164) | ✔ | 12 | 102 | 3 | 0.0 | 0.261 | 0.145 | (0;000) | ✗ | 02/02/17 |
NaPt2Se3 | ICSD | 78788 | P6_3mc (186) | ✗ | 24 | 188 | 1 | 0.8222 | 0.854 | 0.000 | (0;000) | ✗ | 04/08/17 |
BiI3 | ICSD | 78791 | R-3 (148) | ✔ | 8 | 72 | 2 | 1.2702 | 1.298 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li10BrN3 | ICSD | 78819 | P-6m2 (187) | ✗ | 14 | 52 | 1 | 1.4385 | 1.798 | 0.000 | (0;000) | ✗ | 15/02/17 |
Li5Br2N | ICSD | 78836 | Immm (71) | ✔ | 8 | 34 | 1 | 2.2057 | 2.383 | 0.000 | (0;000) | ✗ | 27/01/17 |
Y(PdO2)2 | ICSD | 78846 | I4_1/a (88) | ✔ | 14 | 142 | 3 | 0.0 | 0.000 | 0.696 | (1;111) | ✗ | 27/01/17 |
NaGeAu | ICSD | 78866 | Im2m (44) | ✗ | 6 | 48 | 3 | 0.0 | 0.004 | 0.703 | (1;000) | ✔ | 06/10/16 |
NaZr2TiF11 | ICSD | 78867 | C2/m (12) | ✔ | 15 | 106 | 3 | 0.0 | 0.015 | 0.782 | (0;000) | ✗ | 02/02/17 |
YCBr | ICSD | 78871 | C2/m (12) | ✔ | 6 | 44 | 2 | 0.0 | 0.017 | 0.505 | (0;000) | ✗ | 27/01/17 |
Pd(PbCl3)2 | ICSD | 78873 | P2_1/c (14) | ✔ | 18 | 176 | 3 | 1.4312 | 1.530 | 0.000 | (0;000) | ✗ | 02/02/17 |
Pd(PbBr3)2 | ICSD | 78874 | P2_1/c (14) | ✔ | 18 | 176 | 3 | 1.2748 | 1.375 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbLiSe | ICSD | 78878 | P4/nmm (129) | ✔ | 6 | 36 | 1 | 2.2723 | 2.337 | 0.000 | (0;000) | ✗ | 27/01/17 |
K3ClO | ICSD | 78891 | Pnma (62) | ✔ | 20 | 160 | 1 | 1.1192 | 1.119 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs4KLiGa2F12 | ICSD | 78927 | R-3m (166) | ✔ | 20 | 158 | 1 | 6.6244 | 6.626 | 0.000 | (0;000) | ✗ | 22/03/17 |
Cs4KLiFe2F12 | ICSD | 78928 | R-3m (166) | ✔ | 20 | 148 | 1 | 0.0021 | 0.004 | 0.000 | (0;111) | ✗ | 22/03/17 |
Cs2Mn3Se4 | ICSD | 78932 | Ibam (72) | ✔ | 18 | 174 | 2 | 0.0 | 0.000 | 0.651 | (0;111) | ✗ | 22/03/17 |
Rb2Mn3Se4 | ICSD | 78937 | Ibam (72) | ✔ | 18 | 174 | 2 | 0.0 | 0.000 | 0.540 | (1;100) | ✗ | 02/02/17 |
KLi2As | ICSD | 78938 | Pmmn (59) | ✔ | 8 | 40 | 1 | 0.7738 | 0.774 | 0.000 | (0;000) | ✗ | 05/01/17 |
Al2Te5 | ICSD | 78941 | C2/m (12) | ✔ | 7 | 36 | 3 | 0.768 | 1.019 | 0.000 | (0;000) | ✗ | 30/01/17 |
Cs2PtF6 | ICSD | 78955 | Fm-3m (225) | ✔ | 9 | 70 | 1 | 2.7742 | 2.796 | 0.000 | (0;000) | ✗ | 27/01/17 |
Y2AlGe3 | ICSD | 78969 | Pnma (62) | ✔ | 24 | 148 | 3 | 0.0 | 0.001 | 0.706 | (0;011) | ✗ | 04/08/17 |
Sn5(BIr3)2 | ICSD | 78984 | P-62m (189) | ✗ | 13 | 130 | 3 | 0.0 | 0.000 | 0.323 | ? | ✗ | 06/10/16 |
SrSi | ICSD | 78997 | Cmcm (63) | ✔ | 4 | 28 | 1 | 0.0 | 0.001 | 0.165 | (0;110) | ✗ | 27/01/17 |
Fe(SiP)4 | ICSD | 79005 | P1 (1) | ✗ | 9 | 44 | 3 | 1.0026 | 1.287 | 0.000 | (0;000) | ✗ | 06/10/16 |
Si4P4Ru | ICSD | 79006 | P1 (1) | ✗ | 9 | 52 | 3 | 1.442 | 1.660 | 0.000 | (0;000) | ✗ | 06/10/16 |
K3GeH2NO3 | ICSD | 79078 | P-1 (2) | ✔ | 20 | 112 | 1 | 3.4275 | 3.479 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaInH8(NF3)2 | ICSD | 79099 | Fm-3m (225) | ✔ | 18 | 82 | 1 | 5.5786 | 5.580 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba(NiP2)2 | ICSD | 79105 | I4/mmm (139) | ✔ | 7 | 50 | 2 | 0.0 | 0.004 | 0.466 | (0;000) | ✗ | 05/01/17 |
CaMg2N2 | ICSD | 79123 | P-3m1 (164) | ✔ | 5 | 40 | 2 | 2.0892 | 2.089 | 0.000 | (0;000) | ✗ | 27/01/17 |
Nb3TeCl7 | ICSD | 79213 | P-3m1 (164) | ✔ | 22 | 188 | 1 | 0.7075 | 0.708 | 0.000 | (0;000) | ✗ | 07/08/17 |
SiRh | ICSD | 79233 | P2_13 (198) | ✗ | 8 | 84 | 3 | 0.0 | 0.000 | 0.247 | (1;111) | ✔ | 10/04/17 |
Ba(Cu3As)2 | ICSD | 79256 | P4/mmm (123) | ✔ | 9 | 86 | 2 | 0.0 | 0.002 | 0.654 | (1;001) | ✗ | 05/01/17 |
CrGeTe3 | ICSD | 79270 | R-3 (148) | ✔ | 10 | 72 | 2 | 0.0 | 0.031 | 0.084 | (1;111) | ✗ | 02/02/17 |
TiFeO3 | ICSD | 79278 | R3c (161) | ✗ | 10 | 76 | 3 | 0.5011 | 0.525 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrNb4O6 | ICSD | 79355 | P4/mmm (123) | ✔ | 22 | 196 | 3 | 0.0 | 0.003 | 0.920 | (1;001) | ✗ | 07/08/17 |
BiTeCl | ICSD | 79362 | P6_3mc (186) | ✗ | 6 | 36 | 2 | 0.264 | 0.280 | 0.000 | (0;000) | ✔ | 06/10/16 |
BiTeI | ICSD | 79364 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.006 | (1;100) | ✔ | 06/10/16 |
SnS | ICSD | 79374 | C2me (39) | ✗ | 4 | 40 | 2 | 1.0723 | 1.072 | 0.000 | (0;000) | ✗ | 06/10/16 |
NaAlO2 | ICSD | 79404 | Pna2_1 (33) | ✗ | 16 | 96 | 3 | 3.9693 | 4.020 | 0.000 | (0;000) | ✗ | 15/02/17 |
P4N6O | ICSD | 79420 | Pnnm (58) | ✔ | 22 | 112 | 3 | 4.74 | 4.924 | 0.000 | (0;000) | ✗ | 04/08/17 |
Sr2CaIrO6 | ICSD | 79451 | P2_1/c (14) | ✔ | 20 | 166 | 2 | 0.0 | 0.000 | 0.770 | (0;010) | ✗ | 02/02/17 |
BiO2 | ICSD | 79500 | C2/c (15) | ✔ | 12 | 68 | 3 | 1.4798 | 1.526 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi4Te2Br2O9 | ICSD | 79508 | Pmm2 (25) | ✗ | 17 | 140 | 1 | 0.0 | 0.086 | 0.192 | (0;000) | ✔ | 26/04/17 |
CdInBr3 | ICSD | 79512 | Pnma (62) | ✔ | 20 | 184 | 2 | 2.0556 | 2.245 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaBiClO2 | ICSD | 79532 | Cmcm (63) | ✔ | 10 | 88 | 1 | 3.0027 | 3.028 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na2Zr(CuS2)2 | ICSD | 79536 | C2/m (12) | ✔ | 9 | 68 | 1 | 0.0 | 0.012 | 0.006 | (1;000) | ✗ | 27/01/17 |
PdSO4 | ICSD | 79559 | C2/c (15) | ✔ | 12 | 96 | 3 | 1.1467 | 1.229 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr | ICSD | 79592 | P6/mmm (191) | ✔ | 1 | 10 | 1 | 0.0 | 0.022 | 0.520 | (0;000) | ✗ | 27/01/17 |
ScSiRh | ICSD | 79596 | Pnma (62) | ✔ | 12 | 128 | 3 | 0.0 | 0.028 | 0.421 | (0;000) | ✗ | 27/01/17 |
ScSiPt | ICSD | 79597 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.003 | 0.756 | (0;011) | ✗ | 27/01/17 |
YSiNi | ICSD | 79598 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.000 | 0.811 | (0;011) | ✗ | 02/02/17 |
Tl2PdSe2 | ICSD | 79601 | Pbam (55) | ✔ | 10 | 112 | 3 | 0.0 | 0.318 | 0.215 | (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 |
Ti3Se4 | ICSD | 79629 | P6_3/m (176) | ✔ | 14 | 120 | 3 | 0.0 | 0.004 | 0.245 | (0;000) | ✗ | 02/02/17 |
V2PO5 | ICSD | 79681 | I4_1/amd (141) | ✔ | 16 | 122 | 3 | 0.0 | 0.000 | 0.725 | (1;111) | ✗ | 27/01/17 |
AlH2PbO2F3 | ICSD | 79740 | P-1 (2) | ✔ | 18 | 104 | 2 | 4.138 | 4.338 | 0.000 | (0;000) | ✗ | 05/01/17 |
TiS2 | ICSD | 79803 | C2/m (12) | ✔ | 3 | 24 | 2 | 0.0 | 0.377 | 0.035 | (0;000) | ✔ | 06/10/16 |
Sr2LiSiO4F | ICSD | 79805 | P2_1/m (11) | ✔ | 18 | 116 | 1 | 4.9851 | 5.080 | 0.000 | (0;000) | ✗ | 02/02/17 |
HfO2 | ICSD | 79913 | Pbca (61) | ✔ | 24 | 192 | 3 | 4.3367 | 4.480 | 0.000 | (0;000) | ✗ | 04/08/17 |
ZrO2 | ICSD | 79915 | Pnma (62) | ✔ | 12 | 64 | 3 | 2.7017 | 2.702 | 0.000 | (0;000) | ✗ | 27/01/17 |