▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
KNiF3 | COD | 5910032 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 0.0 | 0.000 | 0.596 | (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 |
FeO2 | COD | 9015156 | Cmcm (63) | ✔ | 6 | 40 | 2 | 0.0 | 0.022 | 0.728 | (0;000) | ✗ | 27/01/17 |
FeS2 | COD | 9013067 | Pnnm (58) | ✔ | 6 | 40 | 3 | 0.8098 | 1.147 | 0.000 | (0;000) | ✗ | 27/01/17 |
TlF | COD | 1520825 | P4/nmm (129) | ✔ | 4 | 40 | 1 | 2.7739 | 2.809 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrCd3 | COD | 2106135 | P4/mmm (123) | ✔ | 4 | 40 | 3 | 0.0 | 0.000 | 0.628 | (1;111) | ✗ | 27/01/17 |
RbMgF3 | ICSD | 49585 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 7.6344 | 7.759 | 0.000 | (0;000) | ✗ | 27/01/17 |
HfGe2 | COD | 2310673 | Cmcm (63) | ✔ | 6 | 40 | 3 | 0.0 | 0.016 | 0.222 | (1;000) | ✗ | 27/01/17 |
Fe2Ge | ICSD | 632021 | P6_3/mmc (194) | ✔ | 6 | 40 | 3 | 0.0 | 0.012 | 0.772 | (0;000) | ✗ | 27/01/17 |
CrSe | ICSD | 24792 | P6_3/mmc (194) | ✔ | 4 | 40 | 3 | 0.0 | 0.000 | 0.586 | (1;000) | ✔ | 06/10/16 |
Fe2C | ICSD | 87128 | Pnnm (58) | ✔ | 6 | 40 | 3 | 0.0 | 0.005 | 0.565 | (0;110) | ✗ | 27/01/17 |
ZnFe3C | ICSD | 76763 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 0.0 | 0.000 | 0.444 | (1;111) | ✗ | 27/01/17 |
Al3GaN4 | ICSD | 187056 | P-43m (215) | ✗ | 8 | 42 | 3 | 3.347 | 3.347 | 0.000 | (0;000) | ✗ | 06/10/16 |
AgClO4 | ICSD | 100280 | I-42m (121) | ✗ | 6 | 42 | 3 | 2.7542 | 3.311 | 0.000 | (0;000) | ✗ | 07/10/16 |
CaAu | ICSD | 54978 | Cmcm (63) | ✔ | 4 | 42 | 1 | 0.0 | 0.000 | 0.634 | (0;000) | ✗ | 05/01/17 |
AuN2 | ICSD | 166465 | Pmnn (58) | ✔ | 6 | 42 | 2 | 0.0 | 0.000 | 0.791 | (0;101) | ✗ | 06/10/16 |
Al2CdS4 | ICSD | 25634 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.6241 | 2.624 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2CdS4 | ICSD | 67218 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.9268 | 2.969 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2CdS4 | ICSD | 83526 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.885 | 2.993 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2CdSe4 | ICSD | 174192 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.0835 | 2.084 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2CdSe4 | ICSD | 51421 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.2148 | 2.215 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2CdSe4 | ICSD | 51422 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.9423 | 1.942 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2CdSe4 | ICSD | 83527 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.1509 | 2.151 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2CdTe4 | ICSD | 25640 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.4572 | 1.457 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2CdSe4 | ICSD | 25637 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.2118 | 2.212 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2HgSe4 | ICSD | 183396 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.582 | 1.582 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2HgS4 | ICSD | 25635 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.2212 | 2.221 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2HgSe4 | ICSD | 183502 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.5998 | 1.600 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2HgSe4 | ICSD | 25638 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.5826 | 1.583 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2HgSe4 | ICSD | 33827 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.5688 | 1.569 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2HgTe4 | ICSD | 25641 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.0557 | 1.056 | 0.000 | (0;000) | ✗ | 06/10/16 |
Co2B | ICSD | 30447 | I4/mcm (140) | ✔ | 6 | 42 | 3 | 0.0 | 0.000 | 0.495 | (1;111) | ✗ | 06/10/16 |
Al2ZnS4 | ICSD | 609280 | R3m (160) | ✗ | 7 | 42 | 2 | 0.0 | 0.304 | 0.367 | (0;000) | ✔ | 06/10/16 |
MnCu2Sb | ICSD | 53312 | Fm-3m (225) | ✔ | 4 | 42 | 3 | 0.0 | 0.025 | 0.543 | (0;000) | ✗ | 27/01/17 |
Al2ZnSe4 | ICSD | 181354 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.1157 | 2.116 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2ZnSe4 | ICSD | 25636 | I-4 (82) | ✗ | 7 | 42 | 3 | 2.3639 | 2.364 | 0.000 | (0;000) | ✗ | 06/10/16 |
Al2ZnTe4 | ICSD | 25639 | I-4 (82) | ✗ | 7 | 42 | 3 | 1.488 | 1.488 | 0.000 | (0;000) | ✗ | 06/10/16 |
Si3NiP4 | ICSD | 39452 | I-42m (121) | ✗ | 8 | 42 | 3 | 0.3269 | 0.532 | 0.000 | (0;000) | ✔ | 07/10/16 |
BiSe | ICSD | 72197 | F2mm (42) | ✗ | 4 | 42 | 2 | 0.0 | 0.033 | 0.537 | (1;110) | ✔ | 06/10/16 |
GaB3N4 | ICSD | 187050 | P-43m (215) | ✗ | 8 | 42 | 3 | 3.7874 | 3.787 | 0.000 | (0;000) | ✗ | 06/10/16 |
K3Bi | ICSD | 58793 | Fm-3m (225) | ✔ | 4 | 42 | 1 | 0.0 | 0.000 | 0.012 | (1;000) | ✗ | 05/01/17 |
CaAg | COD | 1509163 | Cmcm (63) | ✔ | 4 | 42 | 1 | 0.0 | 0.000 | 0.626 | (0;000) | ✗ | 05/01/17 |
NbAgO3 | ICSD | 55649 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 1.4258 | 1.496 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ca(AlGa)2 | ICSD | 300209 | I4/mmm (139) | ✔ | 5 | 42 | 3 | 0.0 | 0.016 | 0.303 | (0;000) | ✗ | 05/01/17 |
HfAl3 | ICSD | 608064 | I4/mmm (139) | ✔ | 8 | 42 | 3 | 0.0 | 0.028 | 0.779 | (1;000) | ✗ | 05/01/17 |
FeHO2 | ICSD | 24885 | Cmcm (63) | ✔ | 8 | 42 | 3 | 0.0 | 0.000 | 0.734 | (0;000) | ✗ | 27/01/17 |
TiFe2Sn | COD | 1523643 | Fm-3m (225) | ✔ | 4 | 42 | 3 | 0.0 | 0.019 | 0.026 | (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 |
SnI4 | ICSD | 18010 | P-43m (215) | ✗ | 5 | 42 | 1 | 0.8791 | 0.882 | 0.000 | (0;000) | ✗ | 06/10/16 |
SnF4 | COD | 1528582 | I4/mmm (139) | ✔ | 5 | 42 | 2 | 3.52 | 3.723 | 0.000 | (0;000) | ✗ | 27/01/17 |