▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▴ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
H2CO | ICSD | 151343 | R3c (161) | ✗ | 24 | 72 | 3 | 6.4755 | 6.532 | 0.000 | (0;000) | ✗ | 04/08/17 |
H4CN | COD | 2100665 | P2_1/c (14) | ✔ | 24 | 52 | 1 | 4.7319 | 4.878 | 0.000 | (0;000) | ✗ | 04/08/17 |
H4CN | COD | 2100668 | P2_1/c (14) | ✔ | 24 | 52 | 1 | 4.4325 | 4.433 | 0.000 | (0;000) | ✗ | 04/08/17 |
H4CN | COD | 2100671 | P2_1/c (14) | ✔ | 24 | 52 | 1 | 4.4543 | 4.534 | 0.000 | (0;000) | ✗ | 04/08/17 |
H4CO | COD | 4503066 | P2_12_12_1 (19) | ✗ | 24 | 56 | 1 | 5.7653 | 5.781 | 0.000 | (0;000) | ✗ | 04/08/17 |
HC | COD | 4501704 | P2_1/c (14) | ✔ | 24 | 60 | 1 | 4.4352 | 4.498 | 0.000 | (0;000) | ✗ | 04/08/17 |
HCO | COD | 7100673 | Pc (7) | ✗ | 24 | 88 | 1 | 3.0002 | 3.069 | 0.000 | (0;000) | ✗ | 04/08/17 |
CI | COD | 2212043 | P2_1/c (14) | ✔ | 24 | 132 | 1 | 0.9107 | 1.054 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2CO3 | COD | 9009645 | P2_1/c (14) | ✔ | 24 | 160 | 1 | 3.9261 | 3.926 | 0.000 | (0;000) | ✗ | 04/08/17 |
Pb7(ClF6)2 | COD | 1523195 | P-6 (174) | ✗ | 21 | 196 | 3 | 3.7981 | 3.847 | 0.000 | (0;000) | ✗ | 04/08/17 |
GaCl2 | ICSD | 62664 | Pnna (52) | ✔ | 24 | 216 | 1 | 3.7899 | 3.803 | 0.000 | (0;000) | ✗ | 04/08/17 |
Sr7(H6Cl)2 | ICSD | 418948 | P-6 (174) | ✗ | 21 | 96 | 1 | 3.8726 | 3.886 | 0.000 | (0;000) | ✗ | 04/08/17 |
Mg(ClO4)2 | COD | 2018117 | P2_1/c (14) | ✔ | 22 | 144 | 3 | 6.019 | 6.019 | 0.000 | (0;000) | ✗ | 04/08/17 |
SiCl2O | COD | 7028092 | P-1 (2) | ✔ | 24 | 144 | 1 | 5.7589 | 5.834 | 0.000 | (0;000) | ✗ | 04/08/17 |
PbCl2 | ICSD | 81978 | P2_1/c (14) | ✔ | 24 | 224 | 3 | 0.8128 | 0.848 | 0.000 | (0;000) | ✗ | 04/08/17 |
SCl2 | ICSD | 38351 | P2_12_12_1 (19) | ✗ | 24 | 160 | 1 | 2.017 | 2.049 | 0.000 | (0;000) | ✗ | 04/08/17 |
SnCl2 | ICSD | 81979 | P2_1/c (14) | ✔ | 24 | 224 | 3 | 0.7863 | 1.125 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsLi2Cl3 | ICSD | 423635 | Pbcn (60) | ✔ | 24 | 144 | 1 | 5.5413 | 5.542 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2CuCl3 | ICSD | 150292 | Pnma (62) | ✔ | 24 | 200 | 1 | 2.0536 | 2.054 | 0.000 | (0;000) | ✗ | 04/08/17 |
Rb2CuCl3 | ICSD | 150294 | Pnma (62) | ✔ | 24 | 200 | 1 | 2.0085 | 2.009 | 0.000 | (0;000) | ✗ | 04/08/17 |
SbCl3F2 | COD | 4031372 | I4 (79) | ✗ | 24 | 160 | 1 | 2.0855 | 2.122 | 0.000 | (0;000) | ✗ | 04/08/17 |
SbCl3F2 | ICSD | 380014 | I-4 (82) | ✗ | 24 | 160 | 1 | 1.5218 | 1.557 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ga2HCl3 | COD | 4320174 | P2_1/c (14) | ✔ | 24 | 192 | 1 | 3.9594 | 3.964 | 0.000 | (0;000) | ✗ | 04/08/17 |
MoS2Cl3 | ICSD | 28062 | P2_1/c (14) | ✔ | 24 | 188 | 1 | 1.3573 | 1.390 | 0.000 | (0;000) | ✗ | 04/08/17 |
Se2NCl3 | ICSD | 84030 | P2_1/c (14) | ✔ | 24 | 152 | 1 | 0.7486 | 0.749 | 0.000 | (0;000) | ✗ | 04/08/17 |