▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Rb6Cl4O | ICSD | 405193 | R-3c (167) | ✔ | 22 | 176 | 1 | 1.7803 | 1.780 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ir(Cl2F3)2 | ICSD | 411351 | P2_1/c (14) | ✔ | 22 | 174 | 1 | 0.0 | 0.000 | 0.660 | (0;101) | ✗ | 04/08/17 |
TaTeCl9 | ICSD | 410947 | P-1 (2) | ✔ | 22 | 164 | 1 | 2.6089 | 2.669 | 0.000 | (0;000) | ✗ | 04/08/17 |
Pt(SCl4)2 | ICSD | 66012 | P2_1/c (14) | ✔ | 22 | 156 | 1 | 1.8649 | 1.874 | 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 |
SbSCl9 | ICSD | 72391 | C2/m (12) | ✔ | 22 | 148 | 1 | 1.8944 | 1.931 | 0.000 | (0;000) | ✗ | 04/08/17 |
SnPCl9 | ICSD | 60093 | P-1 (2) | ✔ | 22 | 164 | 1 | 2.8264 | 2.826 | 0.000 | (0;000) | ✗ | 04/08/17 |
MoPCl9 | COD | 2002166 | P-1 (2) | ✔ | 22 | 164 | 1 | 0.0 | 0.003 | 0.367 | (0;010) | ✗ | 04/08/17 |
NbTeCl9 | ICSD | 410946 | P-1 (2) | ✔ | 22 | 164 | 1 | 2.1471 | 2.222 | 0.000 | (0;000) | ✗ | 04/08/17 |
S5N5Cl | ICSD | 62528 | C2/c (15) | ✔ | 22 | 124 | 1 | 1.4462 | 1.448 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li6CoO4 | ICSD | 62688 | P4_2/nmc (137) | ✔ | 22 | 118 | 3 | 0.0 | 0.000 | 0.950 | (1;000) | ✗ | 04/08/17 |
Cu7Te4 | ICSD | 43048 | P3m1 (156) | ✗ | 22 | 202 | 3 | 0.0 | 0.001 | 0.726 | ? | ✗ | 04/08/17 |
K3SiF7 | ICSD | 23875 | P4/mbm (127) | ✔ | 22 | 160 | 1 | 6.192 | 6.192 | 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 |
H6OF4 | ICSD | 32569 | P-1 (2) | ✔ | 22 | 80 | 1 | 0.0 | 0.009 | 0.628 | (1;000) | ✗ | 04/08/17 |
Rb3NiF7 | COD | 1531513 | P4/mbm (127) | ✔ | 22 | 172 | 1 | 0.9467 | 0.947 | 0.000 | (0;000) | ✗ | 04/08/17 |
Sn3F8 | ICSD | 61162 | P2_1/c (14) | ✔ | 22 | 196 | 3 | 3.6323 | 3.667 | 0.000 | (0;000) | ✗ | 04/08/17 |
Rb3SiF7 | COD | 1531492 | P4/mbm (127) | ✔ | 22 | 160 | 1 | 5.8404 | 5.840 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ge3F8 | ICSD | 427896 | P2_1/c (14) | ✔ | 22 | 136 | 3 | 4.5299 | 4.541 | 0.000 | (0;000) | ✗ | 04/08/17 |
Rb4Fe2S5 | ICSD | 425071 | P-1 (2) | ✔ | 22 | 164 | 1 | 0.0 | 0.013 | 0.100 | (0;101) | ✗ | 04/08/17 |
Fe2P2O7 | COD | 4000291 | P2_1/c (14) | ✔ | 22 | 136 | 3 | 0.4683 | 0.487 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na6FeSe4 | ICSD | 72304 | P6_3mc (186) | ✗ | 22 | 172 | 1 | 0.0 | 0.000 | 0.503 | ? | ✗ | 04/08/17 |
Fe6Ge5 | ICSD | 23471 | C2/m (12) | ✔ | 22 | 136 | 3 | 0.0 | 0.002 | 0.356 | (1;110) | ✗ | 04/08/17 |
Sr3Ga3N5 | COD | 4323351 | P-1 (2) | ✔ | 22 | 188 | 3 | 1.4918 | 1.492 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na4Ge2Se5 | ICSD | 61401 | P-1 (2) | ✔ | 22 | 148 | 1 | 1.8507 | 1.960 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na4RuH6 | ICSD | 638362 | R-3c (167) | ✔ | 22 | 116 | 1 | 1.6539 | 1.654 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li4H6Os | ICSD | 638269 | R-3c (167) | ✔ | 22 | 68 | 1 | 2.3096 | 2.310 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li4RuH6 | ICSD | 638272 | R-3c (167) | ✔ | 22 | 68 | 1 | 2.2498 | 2.250 | 0.000 | (0;000) | ✗ | 04/08/17 |
H7O4 | COD | 9015632 | Ibam (72) | ✔ | 22 | 62 | 2 | 0.0 | 0.000 | 0.810 | (1;111) | ✗ | 04/08/17 |
Mg5H8O9 | COD | 1531175 | P-3m1 (164) | ✔ | 22 | 112 | 1 | 3.7257 | 3.726 | 0.000 | (0;000) | ✗ | 04/08/17 |
In2Si2O7 | COD | 1527984 | Fd-3m (227) | ✔ | 22 | 152 | 3 | 2.1883 | 2.640 | 0.000 | (0;000) | ✗ | 04/08/17 |
SnPCl9 | ICSD | 60094 | Cmme (67) | ✔ | 22 | 164 | 1 | 2.9724 | 3.002 | 0.000 | (0;000) | ✗ | 07/08/17 |
Sc2Si2O7 | COD | 1527983 | Fd-3m (227) | ✔ | 22 | 144 | 3 | 3.6197 | 3.645 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li8TeN2 | ICSD | 247257 | I4_1md (109) | ✗ | 22 | 80 | 1 | 2.2789 | 2.280 | 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 |
Bi4O7 | ICSD | 51778 | P-1 (2) | ✔ | 22 | 124 | 3 | 1.173 | 1.280 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ta2Se8I | ICSD | 35190 | I422 (97) | ✗ | 22 | 162 | 1 | 0.0 | 0.009 | 0.105 | ? | ✗ | 04/08/17 |
K2S2O7 | COD | 4306603 | C2/c (15) | ✔ | 22 | 144 | 1 | 5.7762 | 5.796 | 0.000 | (0;000) | ✗ | 04/08/17 |
Bi9I2 | ICSD | 39257 | P2_1/m (11) | ✔ | 22 | 118 | 3 | 0.0 | 0.000 | 0.931 | (1;011) | ✗ | 06/10/16 |
Li8SeN2 | ICSD | 247255 | I4_1md (109) | ✗ | 22 | 80 | 1 | 1.648 | 1.648 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ta3SeI7 | ICSD | 82791 | P6_3mc (186) | ✗ | 22 | 188 | 2 | 0.5635 | 0.581 | 0.000 | (0;000) | ✗ | 04/08/17 |
K3V5O14 | COD | 4316136 | P31m (157) | ✗ | 22 | 176 | 1 | 2.1357 | 2.244 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li6ZnO4 | ICSD | 62137 | P4_2/nmc (137) | ✔ | 22 | 108 | 3 | 3.6926 | 3.693 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li6WN4 | ICSD | 153620 | P4_2/nmc (137) | ✔ | 22 | 132 | 1 | 2.9707 | 3.006 | 0.000 | (0;000) | ✗ | 04/08/17 |
Li6MoN4 | ICSD | 66095 | P4_2/nmc (137) | ✔ | 22 | 104 | 1 | 2.6915 | 2.731 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ta5N6 | ICSD | 166512 | P6_3/mcm (193) | ✔ | 22 | 190 | 3 | 0.0 | 0.000 | 0.755 | (0;000) | ✗ | 04/08/17 |
Nb5N6 | ICSD | 26252 | P6_3/mcm (193) | ✔ | 22 | 190 | 3 | 0.0 | 0.000 | 0.749 | (0;000) | ✗ | 04/08/17 |
S5N6 | COD | 1529768 | C2/c (15) | ✔ | 22 | 120 | 1 | 2.2357 | 2.285 | 0.000 | (0;000) | ✗ | 04/08/17 |
P4N6O | ICSD | 79420 | Pnnm (58) | ✔ | 22 | 112 | 3 | 4.74 | 4.924 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na2S2O7 | ICSD | 413049 | P-1 (2) | ✔ | 22 | 144 | 1 | 5.6454 | 5.752 | 0.000 | (0;000) | ✗ | 04/08/17 |