▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Tl2MoO4 | COD | 2009101 | P-3m1 (164) | ✔ | 14 | 128 | 3 | 3.034 | 3.116 | 0.000 | (0;000) | ✗ | 02/02/17 |
Te4Mo3 | COD | 2007309 | R-3 (148) | ✔ | 14 | 132 | 3 | 0.0 | 0.095 | 0.033 | (1;111) | ✗ | 02/02/17 |
Tl(TeMo)3 | COD | 1521172 | P6_3/m (176) | ✔ | 14 | 146 | 3 | 0.0 | 0.000 | 0.290 | (0;000) | ✗ | 02/02/17 |
MnTe2 | COD | 9014758 | Pa3 (205) | ✔ | 12 | 108 | 3 | 0.0 | 0.000 | 0.754 | (0;111) | ✗ | 02/02/17 |
MnSe2 | COD | 1010097 | Pa3 (205) | ✔ | 12 | 108 | 3 | 0.0 | 0.000 | 0.381 | (0;111) | ✗ | 02/02/17 |
MnSeO3 | COD | 1533149 | Pnma (62) | ✔ | 20 | 156 | 3 | 0.0 | 0.001 | 0.434 | (0;110) | ✗ | 02/02/17 |
NaMn(SiO3)2 | COD | 9003407 | C2/c (15) | ✔ | 20 | 136 | 3 | 0.0 | 0.033 | 0.285 | (0;000) | ✗ | 02/02/17 |
Mn3WO6 | COD | 2002703 | R-3 (148) | ✔ | 20 | 190 | 3 | 0.0 | 0.008 | 0.504 | (0;000) | ✗ | 02/02/17 |
Mn3TeO6 | COD | 2211528 | R-3 (148) | ✔ | 20 | 174 | 3 | 0.0 | 0.001 | 0.493 | (0;000) | ✗ | 02/02/17 |
MgTa2O6 | COD | 2002433 | P4_2/mnm (136) | ✔ | 18 | 144 | 3 | 2.9855 | 3.037 | 0.000 | (0;000) | ✗ | 02/02/17 |
MgSiO3 | COD | 2105685 | C2/c (15) | ✔ | 20 | 128 | 3 | 4.4588 | 4.459 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ti3AlC2 | COD | 7221324 | P6_3/mmc (194) | ✔ | 12 | 94 | 3 | 0.0 | 0.000 | 0.995 | (1;000) | ✗ | 27/01/17 |
Ta3AlC2 | COD | 4307745 | P6_3/mmc (194) | ✔ | 12 | 100 | 3 | 0.0 | 0.051 | 0.053 | (1;000) | ✗ | 27/01/17 |
Mg(AlC)2 | COD | 4030910 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 1.602 | 2.609 | 0.000 | (0;000) | ✗ | 27/01/17 |
YMg2 | COD | 1522922 | P6_3/mmc (194) | ✔ | 12 | 124 | 1 | 0.0 | 0.000 | 0.439 | (0;000) | ✗ | 02/02/17 |
TiB | COD | 9008946 | Pnma (62) | ✔ | 8 | 60 | 3 | 0.0 | 0.000 | 0.817 | (0;011) | ✗ | 27/01/17 |
TaB | COD | 2310099 | Cmcm (63) | ✔ | 4 | 32 | 3 | 0.0 | 0.035 | 0.321 | (1;000) | ✗ | 27/01/17 |
Ta2B | COD | 1511330 | I4/mcm (140) | ✔ | 6 | 58 | 3 | 0.0 | 0.000 | 0.603 | (0;111) | ✗ | 27/01/17 |
Sc3SnB | COD | 1511324 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.112 | (1;000) | ✗ | 27/01/17 |
ZrBr | COD | 4343762 | R-3m (166) | ✔ | 4 | 22 | 2 | 0.0 | 0.043 | 0.167 | (0;111) | ✗ | 27/01/17 |
TlBr | COD | 9008825 | Pm-3m (221) | ✔ | 2 | 20 | 1 | 1.2438 | 1.649 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiV2O5 | COD | 1529744 | Cmcm (63) | ✔ | 16 | 118 | 2 | 0.0 | 0.000 | 0.985 | (1;000) | ✗ | 02/02/17 |
RbBr | COD | 9008706 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 4.2029 | 4.203 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiYO2 | COD | 1008941 | P2_1/c (14) | ✔ | 16 | 104 | 3 | 4.2319 | 4.232 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiMoS2 | COD | 1531962 | P-1 (2) | ✔ | 16 | 116 | 3 | 0.2758 | 0.281 | 0.000 | (0;000) | ✗ | 02/02/17 |
TiBrO | COD | 1523160 | Pmmn (59) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 0.900 | (0;001) | ✗ | 27/01/17 |
ScBrO | COD | 2206575 | Pmmn (59) | ✔ | 6 | 48 | 2 | 3.3438 | 3.344 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScAu | COD | 1510291 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.714 | (0;111) | ✗ | 05/01/17 |
Br | COD | 9013118 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.7043 | 1.768 | 0.000 | (0;000) | ✗ | 27/01/17 |
Br | COD | 1512496 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.1847 | 1.185 | 0.000 | (0;000) | ✗ | 27/01/17 |
KRuO4 | COD | 1008130 | I4_1/a (88) | ✔ | 12 | 98 | 1 | 0.0 | 0.000 | 0.694 | (1;111) | ✗ | 02/02/17 |
KVO3 | COD | 1527491 | Pbcm (57) | ✔ | 20 | 160 | 1 | 3.0491 | 3.071 | 0.000 | (0;000) | ✗ | 02/02/17 |
KO3 | COD | 1518207 | I4/mcm (140) | ✔ | 16 | 108 | 1 | 0.0 | 0.000 | 0.588 | (0;000) | ✗ | 02/02/17 |
Sr2BrN | COD | 1528372 | R-3m (166) | ✔ | 4 | 32 | 1 | 1.8948 | 1.895 | 0.000 | (0;000) | ✗ | 27/01/17 |
BrN | COD | 9016337 | Pm-3m (221) | ✔ | 2 | 12 | 1 | 0.0 | 0.007 | 0.619 | (0;000) | ✗ | 27/01/17 |
BrN | COD | 9015934 | Fm-3m (225) | ✔ | 2 | 12 | 1 | 0.0 | 0.067 | 0.688 | (0;000) | ✗ | 27/01/17 |
NaBr | COD | 9007464 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 3.9836 | 3.984 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiBr | COD | 9008664 | Fm-3m (225) | ✔ | 2 | 10 | 1 | 4.7584 | 4.758 | 0.000 | (0;000) | ✗ | 27/01/17 |
K3(PtO2)2 | COD | 1528247 | Cmcm (63) | ✔ | 18 | 142 | 3 | 0.0 | 0.000 | 0.390 | (0;000) | ✗ | 02/02/17 |
KBr | COD | 9009734 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 4.2926 | 4.293 | 0.000 | (0;000) | ✗ | 27/01/17 |
K3(NiO2)2 | COD | 1528246 | Cmcm (63) | ✔ | 18 | 142 | 3 | 0.0 | 0.000 | 0.748 | (0;000) | ✗ | 02/02/17 |
K3Na(SO4)2 | COD | 1011019 | P-3m1 (164) | ✔ | 14 | 96 | 1 | 0.0 | 0.003 | 0.251 | (0;000) | ✗ | 02/02/17 |
InBr | COD | 9008982 | Cmcm (63) | ✔ | 4 | 40 | 3 | 1.3219 | 1.469 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrHBr | COD | 9009182 | P4/nmm (129) | ✔ | 6 | 36 | 1 | 3.9561 | 3.979 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2P2Pd | COD | 7221367 | Cmcm (63) | ✔ | 10 | 92 | 2 | 0.4933 | 0.567 | 0.000 | (0;000) | ✗ | 02/02/17 |
HBr | COD | 1010385 | Fm-3m (225) | ✔ | 2 | 8 | 1 | 0.0 | 0.000 | 0.199 | (0;000) | ✗ | 27/01/17 |
HgBr | COD | 9014145 | I4/mmm (139) | ✔ | 4 | 38 | 3 | 1.8884 | 2.563 | 0.000 | (0;000) | ✗ | 27/01/17 |
HfBrN | COD | 1532008 | Pmmn (59) | ✔ | 6 | 48 | 2 | 2.226 | 2.226 | 0.000 | (0;000) | ✗ | 27/01/17 |
TeI | COD | 1527659 | C2/m (12) | ✔ | 8 | 52 | 2 | 0.4248 | 0.727 | 0.000 | (0;000) | ✗ | 02/02/17 |
Te2Ir | COD | 1526498 | Pnma (62) | ✔ | 12 | 116 | 3 | 0.0 | 0.001 | 0.211 | (0;011) | ✗ | 02/02/17 |