▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
GaF3 | COD | 8100893 | R-3c (167) | ✔ | 8 | 68 | 3 | 5.2468 | 5.247 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaFeF3 | COD | 4341415 | Cmcm (63) | ✔ | 10 | 76 | 2 | 0.5613 | 0.591 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeF3 | COD | 2100650 | R-3c (167) | ✔ | 8 | 58 | 3 | 0.0 | 0.001 | 0.309 | (0;000) | ✗ | 27/01/17 |
KHgF3 | COD | 1527535 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.307 | 3.551 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca | COD | 9012917 | Pm-3m (221) | ✔ | 1 | 10 | 1 | 0.0 | 0.000 | 0.233 | (0;000) | ✗ | 27/01/17 |
CaO | COD | 9006708 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 3.649 | 4.030 | 0.000 | (0;000) | ✗ | 27/01/17 |
Nb2O2F3 | COD | 4123273 | C2/c (15) | ✔ | 14 | 118 | 3 | 0.0 | 0.000 | 0.850 | (1;100) | ✗ | 27/01/17 |
Mg3NF3 | COD | 1528307 | Pm-3m (221) | ✔ | 7 | 56 | 3 | 3.7906 | 3.791 | 0.000 | (0;000) | ✗ | 27/01/17 |
KMgF3 | COD | 9006363 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 7.3144 | 7.623 | 0.000 | (0;000) | ✗ | 27/01/17 |
IrF3 | COD | 2310601 | R-3c (167) | ✔ | 8 | 76 | 3 | 1.079 | 1.198 | 0.000 | (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 |
KNiF3 | COD | 5910032 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 0.0 | 0.000 | 0.596 | (0;000) | ✗ | 27/01/17 |
KMnF3 | COD | 4030704 | I4/mcm (140) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.393 | (0;111) | ✗ | 27/01/17 |
CdF2 | COD | 9009006 | Fm-3m (225) | ✔ | 3 | 26 | 3 | 3.0777 | 3.498 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaNiF3 | COD | 2300484 | Cmcm (63) | ✔ | 10 | 80 | 2 | 0.0 | 0.002 | 0.706 | (0;000) | ✗ | 27/01/17 |
NaMgF3 | COD | 9003812 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 6.1969 | 6.641 | 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 |
NaMgF3 | COD | 9010120 | Cmcm (63) | ✔ | 10 | 80 | 3 | 9.6622 | 9.662 | 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 |
CuCl | COD | 9013928 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.5958 | 1.809 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiFeO3 | COD | 9000908 | R-3 (148) | ✔ | 10 | 76 | 3 | 0.0976 | 0.174 | 0.000 | (0;000) | ✗ | 27/01/17 |
Fe2O3 | COD | 1011267 | R-3c (167) | ✔ | 10 | 68 | 3 | 0.0 | 0.040 | 0.793 | (1;000) | ✗ | 27/01/17 |
Li2HfF6 | COD | 4331655 | P-31m (162) | ✔ | 9 | 60 | 1 | 7.595 | 7.681 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiYF4 | COD | 1531435 | I4_1/a (88) | ✔ | 12 | 84 | 3 | 8.7447 | 8.766 | 0.000 | (0;000) | ✗ | 27/01/17 |
YF3 | COD | 1011296 | Pm-3m (221) | ✔ | 12 | 96 | 3 | 4.7827 | 4.951 | 0.000 | (0;000) | ✗ | 27/01/17 |
RuF3 | COD | 2310598 | R-3c (167) | ✔ | 8 | 74 | 3 | 0.0 | 0.000 | 0.240 | (0;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 |
VF3 | COD | 1000468 | R-3c (167) | ✔ | 8 | 68 | 3 | 0.0 | 0.014 | 0.628 | (0;000) | ✗ | 27/01/17 |
TlF3 | COD | 1528563 | Pnma (62) | ✔ | 16 | 136 | 3 | 1.4643 | 1.525 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 1100003 | R-3m (166) | ✔ | 2 | 8 | 2 | 0.0479 | 0.048 | 0.000 | (0;111) | ✗ | 27/01/17 |
K2ZnF4 | COD | 8103552 | I4/mmm (139) | ✔ | 7 | 58 | 2 | 4.3258 | 5.758 | 0.000 | (0;000) | ✗ | 27/01/17 |
KH3F4 | COD | 4124451 | R-3c (167) | ✔ | 16 | 80 | 1 | 6.4747 | 6.534 | 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 |
K2NiF4 | COD | 1527113 | I4/mmm (139) | ✔ | 7 | 56 | 2 | 0.0 | 0.011 | 0.712 | (0;000) | ✗ | 27/01/17 |
C | COD | 9011577 | P6_3/mmc (194) | ✔ | 4 | 16 | 2 | 0.0 | 0.000 | 0.060 | (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 |
Ge(NF3)2 | COD | 9016461 | P-3m1 (164) | ✔ | 9 | 56 | 1 | 0.0 | 0.004 | 0.336 | (0;000) | ✗ | 27/01/17 |
PbF4 | COD | 1528583 | I4/mmm (139) | ✔ | 5 | 42 | 3 | 2.2131 | 2.413 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiYF4 | COD | 1531438 | C2/c (15) | ✔ | 12 | 84 | 3 | 7.555 | 7.555 | 0.000 | (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 |
C | COD | 9012303 | Fd-3m (227) | ✔ | 2 | 8 | 3 | 4.1576 | 5.595 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaMnF4 | COD | 1008528 | P2_1/c (14) | ✔ | 12 | 104 | 2 | 0.0 | 0.014 | 0.033 | (0;000) | ✗ | 27/01/17 |
GaCo | COD | 1525477 | Pm-3m (221) | ✔ | 2 | 30 | 3 | 0.0 | 0.002 | 0.365 | (0;000) | ✗ | 27/01/17 |
CoHO2 | COD | 9009884 | R-3m (166) | ✔ | 4 | 30 | 3 | 1.0064 | 1.165 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2GeF6 | COD | 1010101 | P-3m1 (164) | ✔ | 9 | 64 | 1 | 6.653 | 6.680 | 0.000 | (0;000) | ✗ | 27/01/17 |
SnF4 | COD | 1528582 | I4/mmm (139) | ✔ | 5 | 42 | 2 | 3.52 | 3.723 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiCoO2 | COD | 4505482 | R-3m (166) | ✔ | 4 | 32 | 2 | 1.0657 | 1.109 | 0.000 | (0;000) | ✗ | 27/01/17 |