▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
LaSn | ICSD | 423421 | Cmcm (63) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.738 | (0;000) | ✗ | 06/10/16 |
AgCl | ICSD | 56541 | P2_1/m (11) | ✔ | 4 | 36 | 3 | 0.6845 | 2.523 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeGe | ICSD | 632016 | P6/mmm (191) | ✔ | 6 | 36 | 3 | 0.0 | 0.005 | 0.874 | (0;001) | ✗ | 27/01/17 |
LaSn2 | ICSD | 657383 | Cmmm (65) | ✔ | 6 | 62 | 3 | 0.0 | 0.011 | 0.391 | (1;000) | ✗ | 06/10/16 |
YFeGe2 | ICSD | 632162 | Cmcm (63) | ✔ | 8 | 54 | 3 | 0.0 | 0.000 | 0.686 | (1;110) | ✗ | 27/01/17 |
TiFeH2 | ICSD | 601978 | P2/m (10) | ✔ | 8 | 44 | 3 | 0.0 | 0.017 | 0.760 | (1;100) | ✗ | 27/01/17 |
FePH2O5 | ICSD | 167029 | C2/c (15) | ✔ | 18 | 90 | 3 | 0.0 | 0.000 | 0.307 | (1;100) | ✗ | 27/01/17 |
LaTe3 | ICSD | 642014 | Ccmm (63) | ✔ | 8 | 42 | 2 | 0.0 | 0.000 | 0.968 | (1;000) | ✗ | 06/10/16 |
ZrFeGe | ICSD | 632166 | Pnma (62) | ✔ | 12 | 64 | 3 | 0.0 | 0.084 | 0.291 | (0;000) | ✗ | 27/01/17 |
VFeH2O5 | COD | 9002153 | P-1 (2) | ✔ | 18 | 106 | 3 | 0.0 | 0.018 | 0.312 | (1;110) | ✗ | 27/01/17 |
La2O3 | ICSD | 56166 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 3.0056 | 3.250 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeH2SO5 | COD | 2103101 | C2/c (15) | ✔ | 18 | 92 | 3 | 0.3254 | 0.359 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li2FeS2 | ICSD | 632443 | P-3m1 (164) | ✔ | 5 | 26 | 1 | 0.2773 | 0.277 | 0.000 | (0;000) | ✗ | 27/01/17 |
HfFeSi | ICSD | 632263 | Pnma (62) | ✔ | 12 | 96 | 3 | 0.0 | 0.007 | 0.272 | (1;000) | ✗ | 27/01/17 |
Mg2FeH6 | ICSD | 107500 | Fm-3m (225) | ✔ | 9 | 34 | 3 | 1.4861 | 1.486 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li2O2 | ICSD | 24143 | P6_3/mmc (194) | ✔ | 8 | 36 | 2 | 2.7201 | 2.720 | 0.000 | (0;000) | ✗ | 06/10/16 |
TeO2 | ICSD | 166847 | P2_1/m (11) | ✔ | 12 | 72 | 3 | 2.4449 | 2.506 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfFeP | ICSD | 86280 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.000 | 0.589 | (1;011) | ✗ | 27/01/17 |
Li2Tl | ICSD | 642401 | Cmcm (63) | ✔ | 6 | 38 | 1 | 0.0 | 0.000 | 0.717 | (1;110) | ✗ | 27/01/17 |
Sr2FeH6 | ICSD | 632211 | Fm-3m (225) | ✔ | 9 | 34 | 1 | 1.1713 | 1.247 | 0.000 | (0;000) | ✗ | 27/01/17 |
KFeS2 | COD | 1008340 | C2/c (15) | ✔ | 8 | 58 | 1 | 0.0 | 0.000 | 0.278 | (1;101) | ✗ | 27/01/17 |
FeHO2 | COD | 9002158 | Pnma (62) | ✔ | 16 | 84 | 3 | 0.0 | 0.001 | 0.484 | (1;011) | ✗ | 27/01/17 |
Mg3Sn | ICSD | 70069 | P-1 (2) | ✔ | 8 | 88 | 3 | 0.0 | 0.000 | 0.622 | (1;001) | ✗ | 06/10/16 |
FeHO2 | ICSD | 24885 | Cmcm (63) | ✔ | 8 | 42 | 3 | 0.0 | 0.000 | 0.734 | (0;000) | ✗ | 27/01/17 |
InFeO3 | COD | 2009424 | P6_3/mmc (194) | ✔ | 10 | 78 | 3 | 0.0 | 0.000 | 0.825 | (0;000) | ✗ | 27/01/17 |
MnO2 | ICSD | 20227 | I4/m (87) | ✔ | 12 | 108 | 3 | 0.0 | 0.001 | 0.936 | (1;000) | ✗ | 06/10/16 |
TiFeH | ICSD | 602022 | Pmma (51) | ✔ | 6 | 42 | 3 | 0.0 | 0.000 | 0.748 | (1;100) | ✗ | 27/01/17 |
FeP | COD | 9008932 | Pnma (62) | ✔ | 8 | 52 | 3 | 0.0 | 0.000 | 0.363 | (0;011) | ✗ | 27/01/17 |
FeO2 | COD | 9015156 | Cmcm (63) | ✔ | 6 | 40 | 2 | 0.0 | 0.022 | 0.728 | (0;000) | ✗ | 27/01/17 |
Nb4FeSi | ICSD | 53511 | P4/mcc (124) | ✔ | 12 | 128 | 3 | 0.0 | 0.001 | 0.527 | (0;110) | ✗ | 27/01/17 |
LiFeP | COD | 9008322 | P4/nmm (129) | ✔ | 6 | 32 | 2 | 0.0 | 0.011 | 0.513 | (1;001) | ✗ | 27/01/17 |
LiFeO2 | ICSD | 31149 | I4_1/amd (141) | ✔ | 8 | 46 | 3 | 0.0 | 0.000 | 0.787 | (1;111) | ✗ | 27/01/17 |
MnP | ICSD | 30412 | Pmnb (62) | ✔ | 8 | 80 | 3 | 0.0 | 0.004 | 0.259 | (1;000) | ✗ | 06/10/16 |
CdP4 | ICSD | 25605 | P2_1/c (14) | ✔ | 10 | 64 | 2 | 0.4602 | 0.528 | 0.000 | (0;000) | ✔ | 06/10/16 |
LiFePO4 | ICSD | 97766 | Cmcm (63) | ✔ | 14 | 80 | 3 | 0.1926 | 0.307 | 0.000 | (0;000) | ✗ | 27/01/17 |
MnP4 | ICSD | 100786 | P-1 (2) | ✔ | 10 | 70 | 3 | 0.3988 | 0.496 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeSe | ICSD | 53543 | P4/mmm (123) | ✔ | 2 | 14 | 2 | 0.0 | 0.001 | 0.695 | (0;110) | ✗ | 27/01/17 |
Nb4FeP | ICSD | 632795 | P4/mcc (124) | ✔ | 12 | 130 | 3 | 0.0 | 0.000 | 0.873 | (0;110) | ✗ | 27/01/17 |
FeWN2 | ICSD | 81488 | P6_3/mmc (194) | ✔ | 8 | 64 | 3 | 0.0 | 0.010 | 1.000 | (1;000) | ✗ | 27/01/17 |
MnS2 | ICSD | 643441 | Pnnm (58) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.914 | (0;101) | ✗ | 27/01/17 |
FeMoP | ICSD | 632646 | Pnma (62) | ✔ | 12 | 108 | 3 | 0.0 | 0.000 | 0.423 | (0;011) | ✗ | 27/01/17 |
Na2FeO4 | ICSD | 50478 | Cmcm (63) | ✔ | 14 | 100 | 1 | 0.0 | 0.008 | 0.250 | (1;000) | ✗ | 27/01/17 |
SN | ICSD | 41967 | P2_1/c (14) | ✔ | 8 | 44 | 1 | 0.0 | 0.008 | 0.092 | (0;010) | ✗ | 27/01/17 |
MnTe | ICSD | 643799 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.702 | (0;011) | ✗ | 27/01/17 |
FeSiNi | ICSD | 165244 | Pnma (62) | ✔ | 12 | 88 | 3 | 0.0 | 0.004 | 0.250 | (1;000) | ✗ | 27/01/17 |
NbFeSi | ICSD | 632827 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.001 | 0.330 | (1;011) | ✗ | 27/01/17 |
NbFeO4 | COD | 2002235 | P2/c (13) | ✔ | 12 | 90 | 3 | 0.0 | 0.000 | 0.459 | (0;010) | ✗ | 27/01/17 |
MoN | ICSD | 76280 | P6_3/mmc (194) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.939 | (0;000) | ✗ | 06/10/16 |
AuSe | ICSD | 73669 | C2/m (12) | ✔ | 4 | 34 | 2 | 0.0 | 0.719 | 0.042 | (0;000) | ✔ | 06/10/16 |
NbFeP | ICSD | 632794 | Pnma (62) | ✔ | 12 | 104 | 3 | 0.0 | 0.003 | 0.138 | (0;000) | ✗ | 27/01/17 |
Ni4Mo | ICSD | 105047 | I4/m (87) | ✔ | 5 | 54 | 3 | 0.0 | 0.001 | 0.721 | (1;000) | ✗ | 06/10/16 |
NbFeO4 | COD | 2002236 | C2/m (12) | ✔ | 12 | 90 | 3 | 0.0 | 0.016 | 0.836 | (0;000) | ✗ | 27/01/17 |
FeNiPt2 | ICSD | 42564 | P4/mmm (123) | ✔ | 4 | 38 | 3 | 0.0 | 0.005 | 0.799 | (0;000) | ✗ | 27/01/17 |
Fe(NiSe2)2 | ICSD | 632972 | C2/m (12) | ✔ | 7 | 52 | 3 | 0.0 | 0.038 | 0.621 | (1;111) | ✗ | 27/01/17 |
MoPt | ICSD | 644148 | Pmmb (51) | ✔ | 4 | 48 | 3 | 0.0 | 0.067 | 0.517 | (0;101) | ✗ | 06/10/16 |
Fe(NiO2)2 | ICSD | 109150 | Fd-3m (227) | ✔ | 14 | 104 | 3 | 0.0 | 0.000 | 0.907 | (0;000) | ✗ | 27/01/17 |
FeNi3 | COD | 9013941 | Pm-3m (221) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.765 | (0;000) | ✗ | 27/01/17 |
MoRh | ICSD | 108608 | Pmma (51) | ✔ | 4 | 62 | 3 | 0.0 | 0.000 | 0.802 | (0;001) | ✗ | 27/01/17 |
FeSe | ICSD | 633480 | P4/nmm (129) | ✔ | 4 | 28 | 2 | 0.0 | 0.029 | 0.437 | (0;000) | ✗ | 27/01/17 |
FePd3 | ICSD | 103582 | Pm-3m (221) | ✔ | 4 | 62 | 3 | 0.0 | 0.000 | 0.813 | (0;000) | ✗ | 27/01/17 |
Sr2FeO4 | ICSD | 74421 | I4/mmm (139) | ✔ | 7 | 52 | 2 | 0.0 | 0.003 | 0.768 | (0;000) | ✗ | 27/01/17 |
Sr2FeO3 | ICSD | 251020 | Immm (71) | ✔ | 6 | 46 | 1 | 0.0 | 0.034 | 0.745 | (0;000) | ✗ | 27/01/17 |
FeO2 | COD | 9016406 | Pnma (62) | ✔ | 12 | 80 | 3 | 0.0 | 0.010 | 0.278 | (1;000) | ✗ | 27/01/17 |
Ba | ICSD | 615773 | P6_3/mmc (194) | ✔ | 2 | 20 | 1 | 0.0 | 0.019 | 0.268 | (0;000) | ✗ | 05/01/17 |
AgF2 | ICSD | 20453 | P2_1/c (14) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.514 | (0;001) | ✔ | 06/10/16 |
TlFeO2 | ICSD | 29011 | R-3m (166) | ✔ | 8 | 66 | 3 | 0.0 | 0.007 | 0.271 | (0;000) | ✗ | 27/01/17 |
MoS2 | ICSD | 24000 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.8501 | 1.709 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrFeO2 | COD | 4124111 | P4/mmm (123) | ✔ | 4 | 30 | 2 | 0.0 | 0.013 | 0.678 | (0;000) | ✗ | 27/01/17 |
FeSO4 | ICSD | 23507 | Cmcm (63) | ✔ | 12 | 76 | 3 | 0.0 | 0.071 | 0.098 | (0;000) | ✗ | 27/01/17 |
SrFeO3 | ICSD | 92335 | Pm-3m (221) | ✔ | 5 | 36 | 3 | 0.0 | 0.000 | 0.858 | (1;000) | ✗ | 27/01/17 |
MoS2 | ICSD | 26622 | R-3m (166) | ✔ | 3 | 26 | 2 | 0.0 | 0.053 | 0.331 | (1;111) | ✗ | 27/01/17 |
P4Os | ICSD | 647708 | P2_1/c (14) | ✔ | 10 | 72 | 3 | 1.1626 | 1.319 | 0.000 | (0;000) | ✗ | 27/01/17 |
FePO4 | ICSD | 155065 | Cmcm (63) | ✔ | 12 | 74 | 3 | 0.0 | 0.000 | 0.546 | (0;000) | ✗ | 27/01/17 |
Te2Mo | ICSD | 14349 | P2_1/m (11) | ✔ | 12 | 104 | 2 | 0.0 | 0.034 | 0.170 | (0;000) | ✗ | 06/10/16 |
TiFeO3 | COD | 9000908 | R-3 (148) | ✔ | 10 | 76 | 3 | 0.0976 | 0.174 | 0.000 | (0;000) | ✗ | 27/01/17 |
Fe(PdSe)2 | ICSD | 416515 | Ibam (72) | ✔ | 10 | 112 | 3 | 0.0 | 0.009 | 0.269 | (1;111) | ✗ | 27/01/17 |
Fe(SbO3)2 | ICSD | 40344 | P4_2/mnm (136) | ✔ | 18 | 108 | 3 | 0.0 | 0.012 | 0.041 | (0;000) | ✗ | 27/01/17 |
VFeO4 | ICSD | 82161 | Cmcm (63) | ✔ | 12 | 90 | 3 | 0.0 | 0.000 | 0.500 | (0;000) | ✗ | 27/01/17 |
Pd2N | ICSD | 236605 | P4/mmm (123) | ✔ | 6 | 50 | 3 | 0.0 | 0.020 | 0.753 | (0;111) | ✗ | 06/10/16 |
V2FeO4 | COD | 9012329 | Fd-3m (227) | ✔ | 14 | 116 | 3 | 0.0 | 0.004 | 0.451 | (0;000) | ✗ | 27/01/17 |
Sr2FeOsO6 | ICSD | 251068 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.467 | (0;000) | ✗ | 27/01/17 |
Pd2N | ICSD | 96418 | Pnnm (58) | ✔ | 6 | 82 | 3 | 0.0 | 0.000 | 0.775 | (1;011) | ✗ | 27/01/17 |
FeSO5 | COD | 9003662 | C2/c (15) | ✔ | 14 | 88 | 3 | 0.0 | 0.025 | 0.567 | (0;000) | ✗ | 27/01/17 |
FeP2 | ICSD | 633072 | Pnnm (58) | ✔ | 6 | 36 | 3 | 0.3465 | 0.782 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2FeWO6 | ICSD | 78678 | Fm-3m (225) | ✔ | 10 | 78 | 3 | 0.5396 | 0.540 | 0.000 | (0;000) | ✗ | 27/01/17 |
YN | ICSD | 161079 | P6_3/mmc (194) | ✔ | 4 | 32 | 3 | 0.6511 | 0.930 | 0.000 | (0;000) | ✗ | 06/10/16 |
Si2Os | ICSD | 647776 | C2/m (12) | ✔ | 6 | 48 | 3 | 0.0 | 0.447 | 0.105 | (0;000) | ✔ | 27/01/17 |
Fe | COD | 4113940 | P4/mmm (123) | ✔ | 1 | 8 | 1 | 0.0 | 0.001 | 0.297 | (0;000) | ✗ | 27/01/17 |
OsN2 | ICSD | 157283 | Pmnn (58) | ✔ | 6 | 52 | 3 | 0.0 | 0.040 | 0.182 | (0;000) | ✗ | 06/10/16 |
Fe(SO4)2 | COD | 9003661 | Immm (71) | ✔ | 11 | 68 | 3 | 0.0 | 0.009 | 0.880 | (0;000) | ✗ | 27/01/17 |
YGa2Ni | COD | 1523101 | Cmcm (63) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.900 | (0;000) | ✗ | 27/01/17 |
Zr3Fe | COD | 1527778 | Cmcm (63) | ✔ | 8 | 40 | 3 | 0.0 | 0.007 | 0.727 | (1;000) | ✗ | 27/01/17 |
FeSe2 | COD | 9012125 | Pnnm (58) | ✔ | 6 | 40 | 3 | 0.2989 | 0.802 | 0.000 | (0;000) | ✗ | 27/01/17 |
FeSnRu2 | COD | 1523355 | Fm-3m (225) | ✔ | 4 | 54 | 3 | 0.0 | 0.003 | 0.496 | (0;000) | ✗ | 27/01/17 |
TiFeP | ICSD | 633111 | Pnma (62) | ✔ | 12 | 100 | 3 | 0.0 | 0.000 | 0.580 | (1;011) | ✗ | 27/01/17 |
FePt3 | COD | 9013737 | Pm-3m (221) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.892 | (0;000) | ✗ | 27/01/17 |
PdN2 | ICSD | 191244 | Pnnm (58) | ✔ | 6 | 40 | 2 | 0.0 | 0.013 | 0.578 | (0;000) | ✗ | 06/10/16 |
FePS3 | COD | 1527654 | C2/m (12) | ✔ | 10 | 62 | 2 | 0.1373 | 0.173 | 0.000 | (0;000) | ✗ | 27/01/17 |
TaFeP | ICSD | 633105 | Pnma (62) | ✔ | 12 | 104 | 3 | 0.0 | 0.016 | 0.164 | (0;000) | ✗ | 27/01/17 |
PtN2 | ICSD | 157940 | Pmnn (58) | ✔ | 6 | 40 | 3 | 0.4621 | 0.732 | 0.000 | (0;000) | ✗ | 06/10/16 |