▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
LiBF4 | COD | 1505727 | P3_121 (152) | ✗ | 18 | 102 | 3 | 8.4755 | 8.515 | 0.000 | (0;000) | ✗ | 21/03/17 |
Bi2O3 | COD | 9012328 | P-4b2 (117) | ✗ | 20 | 192 | 3 | 0.0 | 0.000 | 0.728 | ? | ✗ | 21/03/17 |
NaV2Bi3O10 | ICSD | 88455 | P1 (1) | ✗ | 16 | 140 | 3 | 1.6199 | 1.676 | 0.000 | (0;000) | ✗ | 21/03/17 |
KBi(PS3)2 | COD | 8100356 | P2_1 (4) | ✗ | 20 | 140 | 2 | 1.6544 | 1.819 | 0.000 | (0;000) | ✗ | 21/03/17 |
ScBiO3 | COD | 4123993 | C2 (5) | ✗ | 20 | 176 | 3 | 2.1205 | 2.349 | 0.000 | (0;000) | ✗ | 21/03/17 |
BiPd | COD | 9012856 | Cmc2_1 (36) | ✗ | 16 | 264 | 3 | 0.0 | 0.001 | 0.869 | ? | ✗ | 21/03/17 |
FeTeBr7 | ICSD | 39531 | P1 (1) | ✗ | 18 | 126 | 2 | 0.0 | 0.004 | 0.497 | ? | ✗ | 21/03/17 |
RbGeBr3 | ICSD | 65244 | Pna2_1 (33) | ✗ | 20 | 136 | 1 | 1.7386 | 1.741 | 0.000 | (0;000) | ✗ | 21/03/17 |
FeSeBr7 | ICSD | 39528 | Pc (7) | ✗ | 18 | 126 | 1 | 0.0 | 0.000 | 0.345 | (0;100) | ✔ | 21/03/17 |
NaBrO3 | COD | 1010058 | P2_13 (198) | ✗ | 20 | 136 | 1 | 0.9042 | 0.932 | 0.000 | (0;000) | ✗ | 21/03/17 |
BrNO3 | ICSD | 407765 | P2_12_12_1 (19) | ✗ | 20 | 120 | 1 | 2.25 | 2.269 | 0.000 | (0;000) | ✗ | 21/03/17 |
BaCa(CO3)2 | COD | 5910095 | P2_1 (4) | ✗ | 20 | 128 | 1 | 2.2809 | 2.293 | 0.000 | (0;000) | ✗ | 21/03/17 |
H2C2O | COD | 7054718 | P2_1 (4) | ✗ | 20 | 64 | 1 | 3.8994 | 3.899 | 0.000 | (0;000) | ✗ | 21/03/17 |
Hg(CN)2 | ICSD | 15896 | I-42d (122) | ✗ | 20 | 120 | 3 | 3.9723 | 4.059 | 0.000 | (0;000) | ✗ | 21/03/17 |
K2B(CN)3 | ICSD | 262588 | Fdd2 (43) | ✗ | 18 | 96 | 1 | 2.5094 | 2.511 | 0.000 | (0;000) | ✗ | 21/03/17 |
Al4SiC4 | ICSD | 606255 | P6_3mc (186) | ✗ | 18 | 64 | 3 | 0.0 | 0.002 | 0.493 | ? | ✗ | 21/03/17 |
CdHgC4(SN)4 | ICSD | 4102 | I-4 (82) | ✗ | 14 | 84 | 3 | 1.9335 | 1.934 | 0.000 | (0;000) | ✗ | 21/03/17 |
CoSnC4Cl3O4 | ICSD | 69685 | R3 (146) | ✗ | 13 | 92 | 1 | 2.9036 | 2.918 | 0.000 | (0;000) | ✗ | 21/03/17 |
KYH4C4O9 | ICSD | 109947 | P1 (1) | ✗ | 19 | 94 | 3 | 0.0 | 0.025 | 0.247 | (0;000) | ✔ | 21/03/17 |
FeCu2(CN)6 | COD | 1010358 | F-43m (216) | ✗ | 15 | 84 | 3 | 0.0 | 0.000 | 0.630 | ? | ✗ | 21/03/17 |
Ca2MnGaO5 | ICSD | 51466 | Ima2 (46) | ✗ | 18 | 156 | 3 | 0.0 | 0.003 | 0.785 | ? | ✗ | 21/03/17 |
CaZnSiH2O5 | ICSD | 200432 | Cc (9) | ✗ | 20 | 116 | 2 | 3.6898 | 3.739 | 0.000 | (0;000) | ✗ | 21/03/17 |
CaSO4 | COD | 9012207 | C222 (21) | ✗ | 18 | 120 | 1 | 5.7747 | 5.775 | 0.000 | (0;000) | ✗ | 22/03/17 |
CsCS(OF)3 | ICSD | 415056 | P2_1 (4) | ✗ | 18 | 116 | 1 | 5.319 | 5.319 | 0.000 | (0;000) | ✗ | 22/03/17 |
CdCu2GeTe4 | ICSD | 656154 | I-42m (121) | ✗ | 8 | 62 | 3 | 0.0 | 0.009 | 0.129 | (1;000) | ✔ | 22/03/17 |
CdInGaS4 | ICSD | 2465 | P3m1 (156) | ✗ | 7 | 62 | 2 | 0.0 | 0.009 | 0.128 | (1;000) | ✔ | 22/03/17 |
RbCdH2I3O | ICSD | 809 | Cc (9) | ✗ | 16 | 100 | 1 | 2.3934 | 2.394 | 0.000 | (0;000) | ✗ | 22/03/17 |
CdI2 | ICSD | 27291 | P3m1 (156) | ✗ | 18 | 156 | 1 | 1.9604 | 2.172 | 0.000 | (0;000) | ✗ | 22/03/17 |
CdI2 | ICSD | 42210 | P3m1 (156) | ✗ | 18 | 156 | 1 | 1.6622 | 1.903 | 0.000 | (0;000) | ✗ | 22/03/17 |
Li2CdSnS4 | COD | 4302974 | Pmn2_1 (31) | ✗ | 16 | 112 | 2 | 2.0977 | 2.098 | 0.000 | (0;000) | ✗ | 22/03/17 |
TiCdO3 | ICSD | 51698 | Pmc2_1 (26) | ✗ | 20 | 168 | 3 | 0.0 | 0.005 | 0.548 | ? | ✗ | 22/03/17 |
RbCS(OF)3 | ICSD | 415817 | P2_1 (4) | ✗ | 18 | 116 | 1 | 5.2115 | 5.219 | 0.000 | (0;000) | ✗ | 22/03/17 |
H6CN4O3 | COD | 2009875 | Pm (6) | ✗ | 14 | 48 | 1 | 0.0 | 0.001 | 0.173 | (0;100) | ✔ | 22/03/17 |
MoH2Cl2O3 | ICSD | 25031 | Pmn2_1 (31) | ✗ | 16 | 96 | 2 | 0.8466 | 0.889 | 0.000 | (0;000) | ✗ | 22/03/17 |
Hg3(TeCl)2 | ICSD | 27401 | I2_13 (199) | ✗ | 14 | 124 | 3 | 2.0054 | 2.047 | 0.000 | (0;000) | ✗ | 22/03/17 |
PCl3O | COD | 2106202 | Pna2_1 (33) | ✗ | 20 | 128 | 1 | 4.6695 | 4.670 | 0.000 | (0;000) | ✗ | 22/03/17 |
ReNCl4 | COD | 7221223 | P1 (1) | ✗ | 6 | 48 | 1 | 1.2934 | 1.382 | 0.000 | (0;000) | ✗ | 22/03/17 |
FeSeCl7 | ICSD | 39529 | P1 (1) | ✗ | 18 | 126 | 1 | 0.0 | 0.004 | 0.516 | ? | ✗ | 22/03/17 |
FeN3ClO3 | ICSD | 281495 | P6_3mc (186) | ✗ | 16 | 96 | 1 | 1.311 | 1.369 | 0.000 | (0;000) | ✗ | 22/03/17 |
Zn2NCl | ICSD | 425734 | Pna2_1 (33) | ✗ | 16 | 144 | 3 | 2.0638 | 2.072 | 0.000 | (0;000) | ✗ | 22/03/17 |
PbCN2 | COD | 2310547 | Pna2_1 (33) | ✗ | 16 | 112 | 2 | 1.6961 | 1.912 | 0.000 | (0;000) | ✗ | 22/03/17 |
Co2Si3 | ICSD | 625021 | P-4c2 (116) | ✗ | 20 | 184 | 3 | 0.0 | 0.001 | 0.547 | ? | ✗ | 22/03/17 |
Na2CoGeO4 | ICSD | 23425 | Pmn2_1 (31) | ✗ | 16 | 126 | 3 | 0.0 | 0.000 | 0.791 | ? | ✗ | 22/03/17 |
CoSi | COD | 1010036 | P2_13 (198) | ✗ | 8 | 84 | 3 | 0.0 | 0.000 | 0.126 | (1;000) | ✔ | 22/03/17 |
CrOF3 | ICSD | 59123 | P4_1 (76) | ✗ | 20 | 164 | 3 | 0.0 | 0.001 | 0.462 | ? | ✗ | 22/03/17 |
RbLiCrO4 | COD | 2100905 | P31c (159) | ✗ | 14 | 100 | 1 | 3.1623 | 3.225 | 0.000 | (0;000) | ✗ | 22/03/17 |
Nb3CrSe6 | ICSD | 626398 | P6_322 (182) | ✗ | 20 | 178 | 3 | 0.0 | 0.000 | 0.711 | ? | ✗ | 22/03/17 |
Cs2TeH6SO10 | ICSD | 93016 | R3 (146) | ✗ | 20 | 96 | 2 | 0.2894 | 0.323 | 0.000 | (0;000) | ✔ | 22/03/17 |
Cs2LiVO4 | ICSD | 40219 | Cmc2_1 (36) | ✗ | 16 | 116 | 1 | 3.8248 | 3.850 | 0.000 | (0;000) | ✗ | 22/03/17 |
CsGaP3HO10 | ICSD | 409692 | C2 (5) | ✗ | 16 | 98 | 3 | 5.0435 | 5.116 | 0.000 | (0;000) | ✗ | 22/03/17 |