▹ Formula | ▾ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
CuBr | COD | 9013935 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 1.451 | 0.044 | (0;000) | ✗ | 27/01/17 |
C | COD | 9012242 | P6_3/mmc (194) | ✔ | 4 | 16 | 3 | 3.3976 | 4.784 | 0.000 | (0;000) | ✗ | 27/01/17 |
MgB2 | COD | 1526507 | P6/mmm (191) | ✔ | 3 | 16 | 2 | 0.0 | 0.000 | 0.642 | (0;001) | ✗ | 05/01/17 |
CsBr | COD | 9009744 | Fm-3m (225) | ✔ | 2 | 16 | 3 | 0.0 | 0.014 | 0.590 | (1;000) | ✗ | 27/01/17 |
CuCl | COD | 9013928 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.5958 | 1.809 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 9012241 | Im-3m (229) | ✔ | 8 | 32 | 3 | 2.5767 | 3.974 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiC | COD | 5910091 | Fm-3m (225) | ✔ | 2 | 16 | 3 | 0.0 | 0.013 | 0.215 | (0;000) | ✗ | 27/01/17 |
LiAlO2 | COD | 9009880 | R-3m (166) | ✔ | 4 | 18 | 2 | 6.4953 | 6.634 | 0.000 | (0;000) | ✗ | 05/01/17 |
NaBeH3 | COD | 4343940 | Pm-3m (221) | ✔ | 5 | 16 | 1 | 1.0974 | 4.012 | 0.000 | (0;000) | ✗ | 05/01/17 |
BPt | COD | 9008910 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.822 | (0;000) | ✗ | 27/01/17 |
CdF2 | COD | 9009006 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 3.0777 | 3.498 | 0.000 | (0;000) | ✗ | 27/01/17 |
HfC | COD | 9008641 | Fm-3m (225) | ✔ | 2 | 16 | 3 | 0.0 | 0.117 | 0.150 | (1;000) | ✗ | 27/01/17 |
C | COD | 1100003 | R-3m (166) | ✔ | 2 | 8 | 2 | 0.0479 | 0.048 | 0.000 | (0;111) | ✗ | 27/01/17 |
C | COD | 9011577 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.060 | (0;000) | ✗ | 27/01/17 |
FeB2 | COD | 1510682 | P6/mmm (191) | ✔ | 3 | 14 | 3 | 0.0 | 0.001 | 0.477 | (1;000) | ✗ | 05/01/17 |
AlN | COD | 1523095 | Fm-3m (225) | ✔ | 2 | 8 | 3 | 5.1878 | 6.629 | 0.000 | (0;000) | ✗ | 05/01/17 |
GaAg | COD | 1509342 | Pm-3m (221) | ✔ | 2 | 24 | 3 | 0.0 | 0.101 | 0.607 | (0;111) | ✗ | 05/01/17 |
ScAg | COD | 1509537 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.602 | (0;111) | ✗ | 05/01/17 |
B2W | COD | 1510851 | P6/mmm (191) | ✔ | 3 | 20 | 3 | 0.0 | 0.000 | 0.751 | (0;001) | ✗ | 05/01/17 |
CrB | COD | 2310092 | Cmcm (63) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.835 | (0;110) | ✗ | 05/01/17 |
NiB | COD | 9008947 | Cmcm (63) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.399 | (0;110) | ✗ | 27/01/17 |
BPt | COD | 1511304 | P6_3/mmc (194) | ✔ | 4 | 26 | 3 | 0.0 | 0.000 | 0.556 | (1;000) | ✗ | 27/01/17 |
Ca | COD | 9012917 | Pm-3m (221) | ✔ | 1 | 10 | 1 | 0.0 | 0.000 | 0.233 | (0;000) | ✗ | 27/01/17 |
Be2C | COD | 9009053 | Fm-3m (225) | ✔ | 3 | 12 | 1 | 1.1755 | 4.135 | 0.000 | (0;000) | ✗ | 27/01/17 |
CdO | COD | 9006677 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 1.039 | 0.074 | (0;000) | ✗ | 27/01/17 |
CdPd | COD | 1524979 | P4/mmm (123) | ✔ | 2 | 30 | 3 | 0.0 | 0.001 | 0.577 | (1;000) | ✗ | 27/01/17 |
LiCl | COD | 1011314 | Fm-3m (225) | ✔ | 2 | 10 | 1 | 6.2774 | 6.277 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaCl | COD | 2104025 | Pm-3m (221) | ✔ | 2 | 16 | 3 | 4.381 | 4.381 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 4313211 | Fm-3m (225) | ✔ | 1 | 4 | 1 | 0.0 | 0.005 | 0.580 | (0;000) | ✗ | 27/01/17 |
C | COD | 9000046 | Fmmm (69) | ✔ | 2 | 8 | 2 | 0.0 | 0.005 | 0.011 | (0;110) | ✗ | 27/01/17 |
ScAu | COD | 1510291 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.714 | (0;111) | ✗ | 05/01/17 |
CrB2 | COD | 1510641 | P6/mmm (191) | ✔ | 3 | 20 | 3 | 0.0 | 0.008 | 0.696 | (0;001) | ✗ | 05/01/17 |
HfB2 | COD | 1510711 | P6/mmm (191) | ✔ | 3 | 18 | 3 | 0.0 | 0.020 | 0.133 | (0;001) | ✗ | 05/01/17 |
BeO | COD | 1011325 | Fm-3m (225) | ✔ | 2 | 10 | 1 | 6.5102 | 6.607 | 0.000 | (0;000) | ✗ | 05/01/17 |
CuAu | COD | 1510113 | P4/mmm (123) | ✔ | 2 | 22 | 3 | 0.0 | 0.034 | 0.659 | (0;001) | ✗ | 05/01/17 |
AgF | COD | 9008598 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.869 | 0.118 | (0;000) | ✗ | 05/01/17 |
LiAg | COD | 9008815 | Pm-3m (221) | ✔ | 2 | 14 | 3 | 0.0 | 0.195 | 0.497 | (0;111) | ✗ | 05/01/17 |
Ag | COD | 1509145 | P6_3/mmc (194) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.772 | (0;000) | ✗ | 05/01/17 |
B2Mo | COD | 1510763 | P6/mmm (191) | ✔ | 3 | 20 | 3 | 0.0 | 0.003 | 0.667 | (1;000) | ✗ | 05/01/17 |
TiB2 | COD | 2002799 | P6/mmm (191) | ✔ | 3 | 18 | 3 | 0.0 | 0.010 | 0.123 | (0;001) | ✗ | 05/01/17 |
ZrB2 | COD | 1510857 | P6/mmm (191) | ✔ | 3 | 10 | 3 | 0.0 | 0.022 | 0.126 | (0;001) | ✗ | 05/01/17 |
CrB4 | COD | 1511720 | Immm (71) | ✔ | 5 | 26 | 3 | 0.0 | 0.015 | 0.101 | (1;111) | ✗ | 05/01/17 |
Be | COD | 9012017 | P6_3/mmc (194) | ✔ | 2 | 8 | 1 | 0.0 | 0.001 | 0.153 | (1;000) | ✗ | 05/01/17 |
BePd | COD | 9008808 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.053 | 0.538 | (0;000) | ✗ | 05/01/17 |
BN | COD | 1010331 | P6/mmm (191) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.351 | (0;000) | ✗ | 27/01/17 |
BN | COD | 2016173 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 4.1848 | 4.579 | 0.000 | (0;000) | ✗ | 27/01/17 |
VB | COD | 2310100 | Cmcm (63) | ✔ | 4 | 32 | 3 | 0.0 | 0.019 | 0.325 | (1;000) | ✗ | 27/01/17 |
CaF2 | COD | 9007069 | Fm-3m (225) | ✔ | 3 | 24 | 1 | 7.9254 | 8.174 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaO | COD | 9006708 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 3.649 | 4.030 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 9012303 | Fd-3m (227) | ✔ | 2 | 8 | 3 | 4.1576 | 5.595 | 0.000 | (0;000) | ✗ | 27/01/17 |