▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
GaN5O14 | COD | 4321396 | I-4 (82) | ✗ | 20 | 122 | 2 | 1.5613 | 1.575 | 0.000 | (0;000) | ✗ | 22/03/17 |
Ba2YReO6 | ICSD | 97089 | P2_1/c (14) | ✔ | 20 | 164 | 3 | 0.0 | 0.029 | 0.393 | (0;000) | ✗ | 02/02/17 |
NaV(SiO3)2 | COD | 2010143 | C2/c (15) | ✔ | 20 | 132 | 3 | 0.0 | 0.009 | 0.186 | (1;000) | ✗ | 02/02/17 |
Y3GaO6 | ICSD | 155086 | Cmc2_1 (36) | ✗ | 20 | 164 | 3 | 3.998 | 4.127 | 0.000 | (0;000) | ✗ | 22/03/17 |
NaSbO3 | COD | 1010156 | Fd-3m (227) | ✔ | 20 | 128 | 3 | 0.0 | 0.000 | 0.586 | (0;000) | ✗ | 02/02/17 |
V2GaSn2 | COD | 9007790 | Cmce (64) | ✔ | 20 | 268 | 3 | 0.0 | 0.011 | 0.208 | (1;110) | ✗ | 22/03/17 |
Y3GaS6 | ICSD | 635286 | Cmc2_1 (36) | ✗ | 20 | 164 | 3 | 2.0661 | 2.268 | 0.000 | (0;000) | ✗ | 22/03/17 |
NaVO3 | COD | 9011241 | Pnma (62) | ✔ | 20 | 160 | 1 | 2.8739 | 2.938 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsBeF3 | ICSD | 9870 | Pnma (62) | ✔ | 20 | 136 | 1 | 6.8536 | 6.961 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaVO3 | ICSD | 20556 | C2/c (15) | ✔ | 20 | 160 | 1 | 3.2206 | 3.248 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaTi(SiO3)2 | COD | 2104036 | C2/c (15) | ✔ | 20 | 130 | 3 | 0.0 | 0.000 | 0.941 | (0;101) | ✗ | 02/02/17 |
NaSc(SiO3)2 | COD | 9011146 | C2/c (15) | ✔ | 20 | 128 | 3 | 5.1211 | 5.277 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiH2ClO | COD | 2201759 | Cmcm (63) | ✔ | 20 | 72 | 1 | 5.5527 | 5.579 | 0.000 | (0;000) | ✗ | 02/02/17 |
Mn3GeIr | ICSD | 150394 | P2_13 (198) | ✗ | 20 | 264 | 3 | 0.0 | 0.001 | 0.500 | ? | ✗ | 22/03/17 |
NaPS3 | ICSD | 426906 | P2_1/m (11) | ✔ | 20 | 128 | 1 | 2.0626 | 2.123 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba3GeO | ICSD | 50512 | Pnma (62) | ✔ | 20 | 160 | 1 | 0.0982 | 0.098 | 0.000 | (0;000) | ✗ | 02/02/17 |
GaH4NF4 | ICSD | 410849 | I4/mcm (140) | ✔ | 20 | 100 | 2 | 5.5819 | 5.673 | 0.000 | (0;000) | ✗ | 27/01/17 |
Nb3PbS6 | ICSD | 74694 | P6_3/mcm (193) | ✔ | 20 | 178 | 3 | 0.0 | 0.000 | 0.963 | (0;000) | ✗ | 02/02/17 |
TiNb3O6 | ICSD | 280002 | R-3 (148) | ✔ | 20 | 174 | 3 | 0.5492 | 0.739 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li2H2SeO5 | ICSD | 413060 | P2_1 (4) | ✗ | 20 | 88 | 1 | 4.6429 | 4.680 | 0.000 | (0;000) | ✗ | 28/03/17 |
MgInBr3 | ICSD | 402533 | Pnma (62) | ✔ | 20 | 176 | 3 | 1.8247 | 2.328 | 0.000 | (0;000) | ✗ | 02/02/17 |
KMnPH2O5 | ICSD | 71178 | Pmn2_1 (31) | ✗ | 20 | 122 | 1 | 0.0 | 0.000 | 0.886 | ? | ✗ | 28/03/17 |
Cs2NaGaF6 | ICSD | 55003 | R-3m (166) | ✔ | 20 | 164 | 1 | 6.4731 | 6.496 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaClO3 | COD | 1001127 | P2_1/c (14) | ✔ | 20 | 136 | 1 | 4.8842 | 4.976 | 0.000 | (0;000) | ✗ | 02/02/17 |
KClO3 | COD | 2310654 | Pnma (62) | ✔ | 20 | 136 | 1 | 3.1985 | 3.200 | 0.000 | (0;000) | ✗ | 02/02/17 |
MnSbS2Cl | ICSD | 151925 | Pnma (62) | ✔ | 20 | 156 | 3 | 0.0 | 0.001 | 0.373 | (1;011) | ✗ | 02/02/17 |
Li2H2SO5 | COD | 1008190 | P2_1 (4) | ✗ | 20 | 88 | 1 | 5.8538 | 5.854 | 0.000 | (0;000) | ✗ | 28/03/17 |
SrNbO3 | COD | 1521114 | Pnma (62) | ✔ | 20 | 164 | 3 | 0.0 | 0.002 | 0.636 | (0;110) | ✗ | 02/02/17 |
Li2H2SeO5 | COD | 2201760 | P2_1 (4) | ✗ | 20 | 88 | 1 | 4.7043 | 4.704 | 0.000 | (0;000) | ✗ | 28/03/17 |
Ba4Na(SbO4)3 | COD | 2001366 | Im-3m (229) | ✔ | 20 | 136 | 3 | 1.8829 | 1.962 | 0.000 | (0;000) | ✗ | 02/02/17 |
ReClO3 | ICSD | 416751 | P2_1/c (14) | ✔ | 20 | 160 | 1 | 3.6638 | 3.734 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaH3SO5 | COD | 9012547 | Cc (9) | ✗ | 20 | 96 | 1 | 5.3572 | 5.366 | 0.000 | (0;000) | ✗ | 29/03/17 |
RbNbO3 | COD | 1528862 | P-1 (2) | ✔ | 20 | 160 | 1 | 3.6791 | 3.683 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaCrO3 | ICSD | 35029 | P6_3/mmc (194) | ✔ | 20 | 168 | 3 | 0.0 | 0.004 | 0.700 | (1;000) | ✗ | 02/02/17 |
Zn(HO)2 | COD | 9015545 | P2_12_12_1 (19) | ✗ | 20 | 104 | 3 | 3.5812 | 3.581 | 0.000 | (0;000) | ✗ | 28/03/17 |
Zn2SiH2O5 | COD | 9008269 | Imm2 (44) | ✗ | 20 | 120 | 3 | 3.3232 | 3.515 | 0.000 | (0;000) | ✗ | 29/03/17 |
Zr2Ni2Sn | ICSD | 405564 | P4_2/mnm (136) | ✔ | 20 | 168 | 3 | 0.0 | 0.008 | 0.422 | (0;000) | ✗ | 02/02/17 |
Hf9Ni11 | ICSD | 638706 | I4/m (87) | ✔ | 20 | 218 | 3 | 0.0 | 0.001 | 0.502 | (0;000) | ✗ | 29/03/17 |
TcH4NO4 | ICSD | 10429 | I4_1/a (88) | ✔ | 20 | 96 | 1 | 0.0 | 0.735 | 1.000 | (1;111) | ✗ | 29/03/17 |
K2P3 | ICSD | 33260 | Fddd (70) | ✔ | 20 | 132 | 1 | 1.0357 | 1.037 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba4Li(SbO4)3 | ICSD | 202200 | Im-3m (229) | ✔ | 20 | 130 | 3 | 2.0478 | 2.129 | 0.000 | (0;000) | ✗ | 02/02/17 |
TaNi2TeSe | ICSD | 86174 | Pnma (62) | ✔ | 20 | 180 | 2 | 0.0 | 0.001 | 0.907 | (0;011) | ✗ | 02/02/17 |
KHgI3 | COD | 1529983 | Pna2_1 (33) | ✗ | 20 | 168 | 1 | 1.6841 | 1.684 | 0.000 | (0;000) | ✗ | 29/03/17 |
Ni2PdSe2 | ICSD | 419760 | I4/mmm (139) | ✔ | 20 | 200 | 3 | 0.0 | 0.002 | 0.680 | (0;111) | ✗ | 02/02/17 |
Ba4Na(BiO4)3 | ICSD | 77640 | Im-3m (229) | ✔ | 20 | 166 | 3 | 0.0 | 0.000 | 0.084 | (0;000) | ✗ | 02/02/17 |
KInBr3 | ICSD | 50510 | P-3 (147) | ✔ | 20 | 172 | 1 | 2.4275 | 2.428 | 0.000 | (0;000) | ✗ | 02/02/17 |
YNiO3 | ICSD | 191794 | Pnma (62) | ✔ | 20 | 156 | 3 | 0.0 | 0.000 | 0.538 | (0;110) | ✗ | 02/02/17 |
BaYMn2O6 | ICSD | 154011 | C2/m (12) | ✔ | 20 | 174 | 3 | 0.0 | 0.004 | 0.750 | (0;001) | ✗ | 02/02/17 |
CrInBr3 | ICSD | 54136 | P2_1/c (14) | ✔ | 20 | 192 | 3 | 0.0 | 0.006 | 0.247 | (1;000) | ✗ | 02/02/17 |
Ta(NiTe)2 | ICSD | 66346 | Pnma (62) | ✔ | 20 | 180 | 2 | 0.0 | 0.001 | 0.843 | (1;011) | ✗ | 02/02/17 |