▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TlBrO4 | ICSD | 65659 | Pnma (62) | ✔ | 24 | 176 | 1 | 3.7139 | 3.827 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsC2N3 | ICSD | 249791 | C2/c (15) | ✔ | 24 | 128 | 1 | 4.6862 | 4.686 | 0.000 | (0;000) | ✗ | 04/08/17 |
H3C2N | COD | 5000306 | P-1 (2) | ✔ | 24 | 64 | 1 | 3.0551 | 3.102 | 0.000 | (0;000) | ✗ | 04/08/17 |
HC2F | COD | 4116822 | C2/c (15) | ✔ | 24 | 96 | 1 | 4.5863 | 4.606 | 0.000 | (0;000) | ✗ | 04/08/17 |
KC2N3 | ICSD | 411932 | Pnma (62) | ✔ | 24 | 128 | 1 | 3.8498 | 3.850 | 0.000 | (0;000) | ✗ | 04/08/17 |
C3Br2O | COD | 7206336 | P2_1/c (14) | ✔ | 24 | 128 | 1 | 1.2333 | 1.269 | 0.000 | (0;000) | ✗ | 04/08/17 |
H2C3Cl | COD | 2006743 | P2_1/c (14) | ✔ | 24 | 84 | 1 | 4.0279 | 4.071 | 0.000 | (0;000) | ✗ | 04/08/17 |
C3S7O | ICSD | 165374 | P-1 (2) | ✔ | 22 | 120 | 1 | 1.8563 | 2.224 | 0.000 | (0;000) | ✗ | 04/08/17 |
C4S3Cl4 | COD | 7008813 | P-1 (2) | ✔ | 22 | 124 | 1 | 1.7848 | 1.895 | 0.000 | (0;000) | ✗ | 04/08/17 |
H5C4N3 | COD | 2207775 | C2/c (15) | ✔ | 24 | 72 | 1 | 2.9527 | 2.971 | 0.000 | (0;000) | ✗ | 04/08/17 |
C4S3N5 | COD | 4116668 | P-1 (2) | ✔ | 24 | 118 | 1 | 0.0 | 0.002 | 0.875 | (0;010) | ✗ | 04/08/17 |
H10C9O4 | COD | 2229064 | P1 (1) | ✗ | 23 | 70 | 1 | 3.3437 | 3.523 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ca2PN3 | ICSD | 72532 | Cmce (64) | ✔ | 24 | 160 | 1 | 2.5689 | 2.623 | 0.000 | (0;000) | ✗ | 04/08/17 |
CaMnF5 | COD | 1518174 | C2/c (15) | ✔ | 14 | 120 | 1 | 0.0 | 0.002 | 0.361 | (0;000) | ✗ | 04/08/17 |
CaSO4 | COD | 9003569 | Pnma (62) | ✔ | 24 | 160 | 1 | 6.7502 | 6.838 | 0.000 | (0;000) | ✗ | 04/08/17 |
CdI2 | COD | 2106204 | P3m1 (156) | ✗ | 24 | 208 | 1 | 1.9332 | 2.153 | 0.000 | (0;000) | ✗ | 04/08/17 |
CdI2 | ICSD | 108921 | P3m1 (156) | ✗ | 24 | 208 | 1 | 1.9384 | 2.162 | 0.000 | (0;000) | ✗ | 04/08/17 |
CdI2 | ICSD | 9194 | P3m1 (156) | ✗ | 24 | 208 | 1 | 1.8969 | 2.099 | 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 |
HCO | COD | 7100673 | Pc (7) | ✗ | 24 | 88 | 1 | 3.0002 | 3.069 | 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 |
RbCuCl3 | COD | 1527259 | C2 (5) | ✗ | 20 | 164 | 1 | 0.0 | 0.024 | 0.396 | ? | ✗ | 04/08/17 |
MoS2Cl3 | ICSD | 28062 | P2_1/c (14) | ✔ | 24 | 188 | 1 | 1.3573 | 1.390 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsGaCl4 | COD | 7221990 | Pnma (62) | ✔ | 24 | 200 | 1 | 4.7858 | 4.786 | 0.000 | (0;000) | ✗ | 04/08/17 |
NaFeCl4 | COD | 1528827 | P2_12_12_1 (19) | ✗ | 24 | 180 | 1 | 0.0 | 0.000 | 0.328 | ? | ✗ | 04/08/17 |