▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▴ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ca4Al6O13 | ICSD | 245370 | I-43m (217) | ✗ | 23 | 136 | 3 | 4.0244 | 4.073 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsAlBr4 | ICSD | 83435 | Pnma (62) | ✔ | 24 | 160 | 1 | 4.4615 | 4.462 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlTlBr4 | ICSD | 419829 | P2/c (13) | ✔ | 24 | 176 | 1 | 3.6609 | 3.678 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsAlCl4 | COD | 1004044 | Pnma (62) | ✔ | 24 | 160 | 1 | 5.6761 | 5.681 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlCuCl4 | COD | 4322713 | Pna2_1 (33) | ✗ | 24 | 168 | 3 | 2.5852 | 2.585 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlGaCl4 | ICSD | 62232 | P2_1/c (14) | ✔ | 24 | 176 | 1 | 4.2557 | 4.259 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlInCl4 | COD | 2206752 | Pnma (62) | ✔ | 24 | 176 | 1 | 4.1454 | 4.271 | 0.000 | (0;000) | ✗ | 04/08/17 |
KAlCl4 | COD | 1004038 | P2_1 (4) | ✗ | 24 | 160 | 1 | 5.4874 | 5.504 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiAlCl4 | COD | 1004036 | P2_1/c (14) | ✔ | 24 | 136 | 1 | 5.7046 | 5.732 | 0.000 | (0;000) | ✗ | 04/08/17 |
NaAlCl4 | COD | 1004043 | P2_12_12_1 (19) | ✗ | 24 | 160 | 1 | 4.7141 | 4.714 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlTlCl4 | ICSD | 419828 | Pnma (62) | ✔ | 24 | 176 | 1 | 4.3391 | 4.370 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlF3 | COD | 1000238 | Cmcm (63) | ✔ | 24 | 144 | 3 | 7.8409 | 7.841 | 0.000 | (0;000) | ✗ | 04/08/17 |
KAlF4 | COD | 1000208 | P2_1/m (11) | ✔ | 24 | 160 | 1 | 7.1678 | 7.174 | 0.000 | (0;000) | ✗ | 04/08/17 |
RbAlF4 | COD | 1000457 | Pmmn (59) | ✔ | 24 | 160 | 1 | 7.3074 | 7.339 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlH3 | COD | 4307206 | Pnnm (58) | ✔ | 24 | 36 | 3 | 3.0316 | 3.383 | 0.000 | (0;000) | ✗ | 04/08/17 |
KAlH4 | COD | 1532616 | Pnma (62) | ✔ | 24 | 64 | 1 | 5.0402 | 5.300 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiAlH4 | ICSD | 22247 | P2_1/c (14) | ✔ | 24 | 40 | 1 | 5.1658 | 5.345 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlInI4 | ICSD | 418802 | P2_1/m (11) | ✔ | 24 | 176 | 2 | 2.5366 | 2.621 | 0.000 | (0;000) | ✗ | 04/08/17 |
NaAlI4 | ICSD | 400521 | Pnma (62) | ✔ | 24 | 160 | 1 | 3.3972 | 3.397 | 0.000 | (0;000) | ✗ | 04/08/17 |
AlTlI4 | ICSD | 419827 | P2_1/c (14) | ✔ | 24 | 176 | 1 | 2.8112 | 2.879 | 0.000 | (0;000) | ✗ | 04/08/17 |
KAlSb4 | ICSD | 300157 | Pnma (62) | ✔ | 24 | 128 | 3 | 0.1904 | 0.190 | 0.000 | (0;000) | ✗ | 04/08/17 |
TaAlO4 | COD | 9004254 | Pbcn (60) | ✔ | 24 | 160 | 3 | 3.3363 | 3.479 | 0.000 | (0;000) | ✗ | 04/08/17 |
Cs3As2Cl9 | ICSD | 45733 | P321 (150) | ✗ | 14 | 100 | 2 | 2.4958 | 2.496 | 0.000 | (0;000) | ✗ | 04/08/17 |
GeAs2 | ICSD | 610601 | Pbam (55) | ✔ | 24 | 112 | 2 | 0.5739 | 0.682 | 0.000 | (0;000) | ✗ | 04/08/17 |
SiAs2 | ICSD | 611405 | Pbam (55) | ✔ | 24 | 112 | 2 | 0.8047 | 1.083 | 0.000 | (0;000) | ✗ | 04/08/17 |
ZnAs2 | ICSD | 2021 | P2_1/c (14) | ✔ | 24 | 176 | 3 | 0.2561 | 0.256 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsAs3O8 | COD | 2102799 | C2/c (15) | ✔ | 24 | 144 | 3 | 2.8495 | 2.850 | 0.000 | (0;000) | ✗ | 04/08/17 |
K7NbAs4 | ICSD | 380109 | Pmn2_1 (31) | ✗ | 24 | 192 | 1 | 1.2368 | 1.237 | 0.000 | (0;000) | ✗ | 04/08/17 |
K7TaAs4 | ICSD | 380110 | Pmn2_1 (31) | ✗ | 24 | 192 | 1 | 1.1533 | 1.155 | 0.000 | (0;000) | ✗ | 04/08/17 |
Rb7NbAs4 | ICSD | 380111 | Pmn2_1 (31) | ✗ | 24 | 192 | 1 | 0.8901 | 0.979 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba(As3Pt2)2 | ICSD | 62519 | C2/c (15) | ✔ | 22 | 160 | 3 | 0.308 | 0.368 | 0.000 | (0;000) | ✗ | 04/08/17 |
Sr(As3Pt2)2 | ICSD | 62518 | C2/c (15) | ✔ | 22 | 160 | 3 | 0.2122 | 0.304 | 0.000 | (0;000) | ✗ | 04/08/17 |
BiAsO4 | COD | 9011234 | P2_1/c (14) | ✔ | 24 | 176 | 3 | 3.0064 | 3.123 | 0.000 | (0;000) | ✗ | 04/08/17 |
AsBr5F6 | ICSD | 69057 | C2/c (15) | ✔ | 24 | 164 | 3 | 1.3271 | 1.352 | 0.000 | (0;000) | ✗ | 04/08/17 |
AsCl2F3 | ICSD | 33884 | P4/n (85) | ✔ | 24 | 160 | 1 | 3.3147 | 3.340 | 0.000 | (0;000) | ✗ | 04/08/17 |
CoAsSe | ICSD | 41731 | Pbca (61) | ✔ | 24 | 224 | 3 | 0.0838 | 0.173 | 0.000 | (0;000) | ✗ | 04/08/17 |
Cs2Te3As | ICSD | 405235 | P2_1/c (14) | ✔ | 24 | 164 | 3 | 0.8153 | 0.910 | 0.000 | (0;000) | ✗ | 04/08/17 |
AsI5F6 | ICSD | 59115 | C2/c (15) | ✔ | 24 | 164 | 1 | 1.2767 | 1.296 | 0.000 | (0;000) | ✗ | 04/08/17 |
GeAsSe | COD | 1524563 | Pnna (52) | ✔ | 24 | 120 | 2 | 1.459 | 1.513 | 0.000 | (0;000) | ✗ | 04/08/17 |
AsO2 | COD | 9007637 | Pnma (62) | ✔ | 24 | 136 | 3 | 4.0181 | 4.167 | 0.000 | (0;000) | ✗ | 04/08/17 |
AsPO4 | COD | 9009805 | Pnma (62) | ✔ | 24 | 136 | 3 | 4.9731 | 5.116 | 0.000 | (0;000) | ✗ | 04/08/17 |
AsS2 | ICSD | 424590 | P2_1 (4) | ✗ | 24 | 136 | 2 | 1.2111 | 1.211 | 0.000 | (0;000) | ✗ | 04/08/17 |
Mg(AuF4)2 | COD | 1510402 | P2_1/c (14) | ✔ | 22 | 176 | 3 | 2.1334 | 2.147 | 0.000 | (0;000) | ✗ | 04/08/17 |
Zn(AuF4)2 | COD | 1510406 | P2_1/c (14) | ✔ | 22 | 180 | 3 | 1.8997 | 1.965 | 0.000 | (0;000) | ✗ | 04/08/17 |
KAuBr4 | COD | 2008114 | P2_1/c (14) | ✔ | 24 | 192 | 1 | 0.9514 | 0.951 | 0.000 | (0;000) | ✗ | 04/08/17 |
KAuCl4 | COD | 1510092 | P2_1/c (14) | ✔ | 24 | 192 | 1 | 1.4946 | 1.495 | 0.000 | (0;000) | ✗ | 04/08/17 |
PAuCl4 | COD | 1510095 | P2_1/c (14) | ✔ | 24 | 176 | 1 | 2.4563 | 2.502 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiAuF4 | COD | 1510139 | P2/c (13) | ✔ | 24 | 168 | 1 | 2.1239 | 2.131 | 0.000 | (0;000) | ✗ | 04/08/17 |
KAuI4 | COD | 1510186 | P2_1/c (14) | ✔ | 24 | 192 | 1 | 0.3927 | 0.397 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na3AuO2 | COD | 1510250 | P4_2/mnm (136) | ✔ | 24 | 200 | 1 | 1.9989 | 1.999 | 0.000 | (0;000) | ✗ | 04/08/17 |