▹ Formula | ▹ Source | ▴ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
RhSe2 | ICSD | 44868 | Pa3 (205) | ✔ | 12 | 116 | 3 | 0.0 | 0.000 | 0.746 | (1;111) | ✗ | 02/02/17 |
Fe3S4 | ICSD | 44885 | R3m (160) | ✗ | 7 | 48 | 2 | 0.0 | 0.008 | 0.769 | ? | ✗ | 15/02/17 |
Zn(GaS2)2 | ICSD | 44886 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.4117 | 2.412 | 0.000 | (0;000) | ✗ | 06/10/16 |
Zn(GaSe2)2 | ICSD | 44887 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.5742 | 1.574 | 0.000 | (0;000) | ✗ | 06/10/16 |
Zn(GaTe2)2 | ICSD | 44888 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.8143 | 0.814 | 0.000 | (0;000) | ✗ | 06/10/16 |
Mg2SiNi3 | ICSD | 44926 | R-3m (166) | ✔ | 6 | 54 | 3 | 0.0 | 0.028 | 0.204 | (1;111) | ✗ | 27/01/17 |
LiYS2 | ICSD | 44957 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.6757 | 2.755 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiYSe2 | ICSD | 44963 | R-3m (166) | ✔ | 4 | 26 | 2 | 1.0914 | 2.359 | 0.000 | (0;000) | ✗ | 27/01/17 |
NbS | ICSD | 44992 | P6_3/mmc (194) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.878 | (0;000) | ✗ | 27/01/17 |
Mo | ICSD | 45000 | P6/mmm (191) | ✔ | 1 | 14 | 3 | 0.0 | 0.002 | 0.500 | (1;001) | ✗ | 27/01/17 |
BaLiF3 | ICSD | 45310 | Pm-3m (221) | ✔ | 5 | 34 | 1 | 6.6401 | 6.640 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ba2CaMoO6 | ICSD | 45317 | Fm-3m (225) | ✔ | 10 | 80 | 1 | 2.1405 | 2.212 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cs3As2Cl9 | ICSD | 45733 | P321 (150) | ✗ | 14 | 100 | 2 | 2.4958 | 2.496 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsHF2 | ICSD | 45858 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 6.638 | 6.638 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbHF2 | ICSD | 45859 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 6.8504 | 6.883 | 0.000 | (0;000) | ✗ | 27/01/17 |
PbBrCl | ICSD | 45881 | Pnma (62) | ✔ | 12 | 112 | 2 | 2.9126 | 3.004 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiBiO2 | ICSD | 46022 | Ibam (72) | ✔ | 16 | 120 | 1 | 0.7817 | 0.785 | 0.000 | (0;000) | ✗ | 21/03/17 |
LiIO3 | ICSD | 46025 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.7353 | 3.809 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiIO3 | ICSD | 46026 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.706 | 3.793 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiIO3 | ICSD | 46027 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.8029 | 3.878 | 0.000 | (0;000) | ✗ | 06/10/16 |
NaGe2N3 | ICSD | 47100 | Cmc2_1 (36) | ✗ | 12 | 64 | 3 | 2.7533 | 3.033 | 0.000 | (0;000) | ✗ | 06/10/16 |
Na5MnO4 | ICSD | 47101 | Pmn2_1 (31) | ✗ | 20 | 168 | 1 | 0.0 | 0.009 | 0.285 | (1;001) | ✔ | 11/04/17 |
MoS2N2Cl5 | ICSD | 47102 | P-1 (2) | ✔ | 20 | 142 | 1 | 0.5529 | 0.644 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3GeSe3 | ICSD | 47112 | C2/m (12) | ✔ | 14 | 98 | 1 | 1.988 | 2.044 | 0.000 | (0;000) | ✗ | 02/02/17 |
KH3O2 | ICSD | 47114 | P2_1/c (14) | ✔ | 24 | 96 | 1 | 4.2058 | 4.232 | 0.000 | (0;000) | ✗ | 04/08/17 |
RbH3O2 | ICSD | 47115 | Cmc2_1 (36) | ✗ | 12 | 48 | 1 | 2.3548 | 2.373 | 0.000 | (0;000) | ✗ | 15/02/17 |
PtI3 | ICSD | 47120 | C2/c (15) | ✔ | 16 | 124 | 3 | 0.302 | 0.302 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2CrCl4 | ICSD | 47129 | I4/mmm (139) | ✔ | 7 | 60 | 2 | 0.0 | 0.012 | 0.220 | (0;000) | ✗ | 02/02/17 |
Ba4Zr(RuO4)3 | ICSD | 47133 | R-3m (166) | ✔ | 20 | 164 | 3 | 0.0 | 0.002 | 0.486 | (0;111) | ✗ | 21/03/17 |
KBrO3 | ICSD | 47173 | R3m (160) | ✗ | 5 | 34 | 1 | 3.909 | 3.909 | 0.000 | (0;000) | ✗ | 06/10/16 |
KNaTiO3 | ICSD | 47177 | C2/c (15) | ✔ | 12 | 96 | 1 | 3.7164 | 3.740 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsTe4 | ICSD | 47182 | P2_1/c (14) | ✔ | 20 | 132 | 3 | 0.4746 | 0.475 | 0.000 | (0;000) | ✗ | 02/02/17 |
KSc2F7 | ICSD | 47227 | Cmmm (65) | ✔ | 10 | 80 | 3 | 5.8983 | 5.906 | 0.000 | (0;000) | ✗ | 27/01/17 |
Hf(PS3)2 | ICSD | 47228 | Fdd2 (43) | ✗ | 18 | 116 | 3 | 2.1364 | 2.253 | 0.000 | (0;000) | ✗ | 29/03/17 |
K2HfF6 | ICSD | 47243 | P4/mnc (128) | ✔ | 18 | 144 | 1 | 6.7296 | 6.844 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2HfF6 | ICSD | 47244 | Fm-3m (225) | ✔ | 9 | 72 | 1 | 6.1532 | 6.153 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2HfF6 | ICSD | 47246 | P-62m (189) | ✗ | 9 | 72 | 1 | 5.3771 | 5.412 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sc3Si3Ni | ICSD | 48004 | C2/m (12) | ✔ | 14 | 110 | 3 | 0.0 | 0.011 | 0.732 | (0;000) | ✗ | 02/02/17 |
LiRuO2 | ICSD | 48007 | Pnnm (58) | ✔ | 8 | 62 | 3 | 0.0 | 0.000 | 0.833 | (0;000) | ✗ | 27/01/17 |
ZnI2 | ICSD | 48016 | P6/mmm (191) | ✔ | 3 | 26 | 3 | 0.0 | 0.089 | 0.339 | (0;000) | ✗ | 30/01/17 |
Bi(BO2)3 | ICSD | 48025 | C2 (5) | ✗ | 10 | 50 | 3 | 3.639 | 4.023 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiTiO2 | ICSD | 48128 | Fd-3m (227) | ✔ | 16 | 108 | 3 | 0.0 | 0.008 | 0.631 | (1;111) | ✗ | 29/03/17 |
Tl3SbS3 | ICSD | 48133 | R3m (160) | ✗ | 7 | 62 | 3 | 1.2263 | 1.230 | 0.000 | (0;000) | ✗ | 06/10/16 |
V2Se9 | ICSD | 48145 | C2/c (15) | ✔ | 22 | 160 | 2 | 0.4041 | 0.452 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2LiAlF6 | ICSD | 48149 | R-3m (166) | ✔ | 20 | 132 | 1 | 7.5678 | 7.568 | 0.000 | (0;000) | ✗ | 16/03/17 |
Tl2SnS3 | ICSD | 48152 | C2/m (12) | ✔ | 12 | 116 | 1 | 0.6589 | 0.884 | 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 |
Y2Si2Rh | ICSD | 48176 | C2/m (12) | ✔ | 10 | 94 | 3 | 0.0 | 0.002 | 0.553 | (0;110) | ✗ | 27/01/17 |
HgO2 | ICSD | 48214 | C2/m (12) | ✔ | 3 | 24 | 3 | 0.8828 | 1.430 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaSb3 | ICSD | 49000 | C2/m (12) | ✔ | 8 | 50 | 1 | 0.0 | 0.104 | 0.361 | (1;001) | ✔ | 02/02/17 |