▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
AgPPt5 | ICSD | 605633 | P4/mmm (123) | ✔ | 7 | 66 | 3 | 0.0 | 0.001 | 0.756 | (1;110) | ✗ | 05/01/17 |
ZnH2SeO5 | ICSD | 66749 | C2/c (15) | ✔ | 18 | 100 | 3 | 3.248 | 3.248 | 0.000 | (0;000) | ✗ | 27/01/17 |
HgO | ICSD | 24062 | P3_121 (152) | ✗ | 6 | 54 | 3 | 1.2097 | 1.356 | 0.000 | (0;000) | ✗ | 06/10/16 |
V2H2O5 | ICSD | 260368 | C2/m (12) | ✔ | 9 | 58 | 3 | 0.0 | 0.002 | 0.176 | (0;000) | ✗ | 27/01/17 |
ZrP2(HO3)2 | ICSD | 201970 | P-3m1 (164) | ✔ | 11 | 52 | 3 | 4.1243 | 4.124 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zr2H2Pd | ICSD | 638425 | I4/mmm (139) | ✔ | 5 | 28 | 3 | 0.0 | 0.009 | 0.535 | (0;111) | ✗ | 27/01/17 |
H2Se | ICSD | 24584 | Fm-3m (225) | ✔ | 3 | 8 | 1 | 0.0 | 0.000 | 0.366 | (0;000) | ✗ | 27/01/17 |
H2S | ICSD | 24582 | Fm-3m (225) | ✔ | 3 | 8 | 1 | 0.0 | 0.000 | 0.304 | (1;000) | ✗ | 27/01/17 |
SrH2 | ICSD | 155988 | Pnma (62) | ✔ | 12 | 48 | 1 | 3.1611 | 3.845 | 0.000 | (0;000) | ✗ | 27/01/17 |
BiTe | ICSD | 100654 | P-3m1 (164) | ✔ | 12 | 126 | 2 | 0.0457 | 0.097 | 0.000 | (0;001) | ✗ | 06/10/16 |
BaNaBi | ICSD | 413810 | P-62m (189) | ✗ | 9 | 72 | 1 | 0.0066 | 0.007 | 0.000 | (1;000) | ✔ | 06/10/16 |
TiH2 | ICSD | 166235 | Fm-3m (225) | ✔ | 3 | 14 | 3 | 0.0 | 0.016 | 0.315 | (1;000) | ✗ | 27/01/17 |
TiH2 | ICSD | 169609 | I4/mmm (139) | ✔ | 3 | 14 | 3 | 0.0 | 0.017 | 0.130 | (1;000) | ✗ | 27/01/17 |
ZrH2 | ICSD | 164605 | Fm-3m (225) | ✔ | 3 | 6 | 3 | 0.0 | 0.000 | 0.293 | (0;000) | ✗ | 27/01/17 |
KLi2(HO)3 | ICSD | 65148 | P2_1/m (11) | ✔ | 18 | 72 | 1 | 4.944 | 4.953 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaCoF4 | ICSD | 26067 | Ccm2_1 (36) | ✗ | 12 | 94 | 2 | 0.0 | 0.000 | 0.968 | ? | ✗ | 06/10/16 |
SrLiH3 | ICSD | 23978 | Pm-3m (221) | ✔ | 5 | 16 | 1 | 0.0 | 0.157 | 0.120 | (0;000) | ✗ | 27/01/17 |
ZrNiH3 | ICSD | 43277 | Cmcm (63) | ✔ | 10 | 34 | 3 | 0.0 | 0.000 | 0.657 | (1;110) | ✗ | 27/01/17 |
YAgSb2 | ICSD | 190094 | P4/nmm (129) | ✔ | 8 | 64 | 3 | 0.0 | 0.039 | 0.354 | (1;000) | ✗ | 05/01/17 |
K2MgH4 | ICSD | 68358 | I4/mmm (139) | ✔ | 7 | 32 | 1 | 3.3744 | 3.781 | 0.000 | (0;000) | ✗ | 27/01/17 |
TlBi | ICSD | 53967 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.000 | 0.632 | (1;111) | ✗ | 05/01/17 |
BaCoF4 | ICSD | 261189 | Ccm2_1 (36) | ✗ | 12 | 94 | 2 | 0.0 | 0.000 | 0.965 | ? | ✗ | 06/10/16 |
Na2MgH4(SO4)2 | ICSD | 35767 | P-1 (2) | ✔ | 17 | 92 | 1 | 4.7551 | 4.758 | 0.000 | (0;000) | ✗ | 27/01/17 |
H4N2O3 | ICSD | 24013 | Pmmn (59) | ✔ | 18 | 64 | 1 | 3.2893 | 3.361 | 0.000 | (0;000) | ✗ | 27/01/17 |
H4N2O3 | ICSD | 2772 | Pmmn (59) | ✔ | 18 | 64 | 1 | 3.3632 | 3.392 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2H4Pt | ICSD | 638356 | I4/mmm (139) | ✔ | 7 | 32 | 1 | 1.838 | 1.845 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrNi2P2(H2O5)2 | ICSD | 261127 | C2/m (12) | ✔ | 19 | 104 | 3 | 0.0 | 0.004 | 0.488 | (0;000) | ✗ | 27/01/17 |
SiH4 | ICSD | 159307 | P2_1/c (14) | ✔ | 20 | 32 | 2 | 2.7828 | 2.791 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li4H5Rh | ICSD | 26225 | Cmcm (63) | ✔ | 20 | 68 | 1 | 0.0 | 0.040 | 0.723 | (0;110) | ✗ | 27/01/17 |
BaCoO3 | ICSD | 88670 | C2mm (38) | ✗ | 10 | 74 | 1 | 0.0 | 0.000 | 0.897 | ? | ✗ | 06/10/16 |
K2H6PbO6 | ICSD | 92466 | R-3 (148) | ✔ | 15 | 74 | 1 | 2.6398 | 2.640 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li2H6PtO6 | ICSD | 251041 | P-3 (147) | ✔ | 15 | 58 | 1 | 2.847 | 2.876 | 0.000 | (0;000) | ✗ | 27/01/17 |
H6Pd(NO)4 | ICSD | 420291 | P-1 (2) | ✔ | 15 | 68 | 1 | 2.4183 | 2.602 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2H6PtO6 | ICSD | 251042 | P-3 (147) | ✔ | 15 | 70 | 1 | 2.8576 | 2.890 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2Sn(HO)6 | ICSD | 92464 | R-3 (148) | ✔ | 15 | 74 | 1 | 4.3005 | 4.530 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScAgSe2 | ICSD | 155115 | P-3m1 (164) | ✔ | 4 | 34 | 3 | 0.4242 | 1.112 | 0.000 | (0;000) | ✗ | 05/01/17 |
Sr2H6Os | ICSD | 638409 | Fm-3m (225) | ✔ | 9 | 42 | 1 | 2.1582 | 2.298 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2H6Ru | ICSD | 655142 | Fm-3m (225) | ✔ | 9 | 42 | 1 | 2.2212 | 2.291 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(H4N5)2 | ICSD | 421952 | P-1 (2) | ✔ | 19 | 70 | 1 | 4.165 | 4.209 | 0.000 | (0;000) | ✗ | 27/01/17 |
Hf2Hg | ICSD | 638564 | I4/mmm (139) | ✔ | 3 | 36 | 3 | 0.0 | 0.039 | 0.526 | (0;111) | ✗ | 27/01/17 |
Hf2SN2 | ICSD | 250914 | Immm (71) | ✔ | 5 | 40 | 3 | 1.62 | 1.644 | 0.000 | (0;000) | ✗ | 27/01/17 |
Hf2SN2 | ICSD | 250915 | P-3m1 (164) | ✔ | 5 | 40 | 3 | 0.4848 | 1.577 | 0.000 | (0;000) | ✗ | 27/01/17 |
Hf2Ni2Sn | ICSD | 107096 | P4/mbm (127) | ✔ | 10 | 116 | 3 | 0.0 | 0.001 | 0.879 | (0;001) | ✗ | 27/01/17 |
TiAg | ICSD | 605934 | P4/nmm (129) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.673 | (0;001) | ✗ | 05/01/17 |
Hf2NiP | ICSD | 405616 | P2_1/m (11) | ✔ | 8 | 78 | 3 | 0.0 | 0.000 | 0.949 | (0;000) | ✗ | 27/01/17 |
Bi2Pt | ICSD | 428088 | P31m (157) | ✗ | 9 | 60 | 3 | 0.0 | 0.005 | 0.393 | (0;000) | ✔ | 06/10/16 |
Hf2Pt3 | ICSD | 190810 | I4/mmm (139) | ✔ | 5 | 54 | 3 | 0.0 | 0.004 | 0.850 | (0;111) | ✗ | 27/01/17 |
Hf2S | ICSD | 43203 | P6_3/mmc (194) | ✔ | 6 | 60 | 3 | 0.0 | 0.002 | 0.476 | (0;000) | ✗ | 27/01/17 |
Hf2Si | ICSD | 42523 | I4/mcm (140) | ✔ | 6 | 56 | 3 | 0.0 | 0.011 | 0.330 | (1;000) | ✗ | 27/01/17 |
Hf2Zn | ICSD | 639016 | I4/mmm (139) | ✔ | 3 | 36 | 3 | 0.0 | 0.056 | 0.428 | (0;111) | ✗ | 27/01/17 |
Hf3Si2 | ICSD | 53041 | P4/mbm (127) | ✔ | 10 | 88 | 3 | 0.0 | 0.002 | 0.762 | (1;001) | ✗ | 27/01/17 |
Hf3Te2 | ICSD | 75936 | I4/mmm (139) | ✔ | 5 | 48 | 2 | 0.0 | 0.011 | 0.811 | (0;000) | ✗ | 27/01/17 |
Hf | ICSD | 76412 | Im-3m (229) | ✔ | 1 | 12 | 3 | 0.0 | 0.000 | 0.525 | (0;000) | ✗ | 27/01/17 |
HfSiIr | ICSD | 638584 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.001 | 0.481 | (1;011) | ✗ | 27/01/17 |
HgO | ICSD | 639125 | P3_221 (154) | ✗ | 6 | 54 | 3 | 1.4576 | 1.628 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfMnSi | ICSD | 53024 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.001 | 0.695 | (1;011) | ✗ | 27/01/17 |
YBi | ICSD | 58869 | Fm-3m (225) | ✔ | 2 | 16 | 3 | 0.0 | 0.024 | 0.255 | (1;000) | ✗ | 06/10/16 |
HfSiMo | ICSD | 638634 | Pnma (62) | ✔ | 12 | 120 | 3 | 0.0 | 0.027 | 0.407 | (0;000) | ✗ | 27/01/17 |
SrHfN2 | ICSD | 82538 | R-3m (166) | ✔ | 4 | 32 | 2 | 0.3566 | 0.857 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaCuF4 | ICSD | 9930 | Cmc2_1 (36) | ✗ | 12 | 98 | 2 | 0.0 | 0.000 | 0.474 | (1;000) | ✔ | 28/11/16 |
HfNi2Sb | ICSD | 638718 | P6_3/mmc (194) | ✔ | 8 | 74 | 3 | 0.0 | 0.000 | 0.873 | (0;000) | ✗ | 27/01/17 |
Hf(SiNi)2 | ICSD | 638721 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.013 | 0.559 | (0;000) | ✗ | 27/01/17 |
BaFeF4 | ICSD | 65252 | Ccm2_1 (36) | ✗ | 12 | 92 | 2 | 0.0333 | 0.270 | 0.000 | (0;000) | ✔ | 06/10/16 |
HfNi3 | ICSD | 638697 | R-3m (166) | ✔ | 12 | 126 | 3 | 0.0 | 0.147 | 0.426 | (0;111) | ✗ | 27/01/17 |
Hf(Ni2P)2 | ICSD | 638711 | P4_2/mnm (136) | ✔ | 14 | 124 | 3 | 0.0 | 0.014 | 0.579 | (1;000) | ✗ | 27/01/17 |
HfNiP | ICSD | 638712 | Pnma (62) | ✔ | 12 | 108 | 3 | 0.0 | 0.001 | 0.313 | (0;011) | ✗ | 27/01/17 |
HfSiNi | ICSD | 638723 | Pnma (62) | ✔ | 12 | 104 | 3 | 0.0 | 0.016 | 0.090 | (1;000) | ✗ | 27/01/17 |
HfO2 | ICSD | 83863 | Pnma (62) | ✔ | 12 | 96 | 3 | 3.3241 | 3.324 | 0.000 | (0;000) | ✗ | 27/01/17 |
Al2B2Ru3 | ICSD | 43843 | Cmmm (65) | ✔ | 7 | 60 | 3 | 0.0 | 0.018 | 0.778 | (1;111) | ✗ | 05/01/17 |
ZrBi | ICSD | 409756 | Cmcm (63) | ✔ | 12 | 54 | 3 | 0.0 | 0.000 | 0.702 | (1;110) | ✗ | 06/10/16 |
HfPbO3 | ICSD | 161702 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 2.1252 | 2.134 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrHfO3 | ICSD | 89385 | I4/mcm (140) | ✔ | 10 | 80 | 3 | 3.9522 | 3.958 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaFeF4 | ICSD | 82765 | Ccm2_1 (36) | ✗ | 12 | 92 | 2 | 0.0565 | 0.274 | 0.000 | (0;000) | ✔ | 06/10/16 |
BaAl2 | ICSD | 246193 | Fd-3m (227) | ✔ | 6 | 32 | 3 | 0.0 | 0.000 | 0.593 | (0;000) | ✗ | 05/01/17 |
BaAl2(SiO4)2 | ICSD | 188056 | P-3 (147) | ✔ | 13 | 72 | 3 | 0.3812 | 0.447 | 0.000 | (0;000) | ✗ | 05/01/17 |
HfOs2 | ICSD | 638749 | P6_3/mmc (194) | ✔ | 12 | 176 | 3 | 0.0 | 0.001 | 0.573 | (0;000) | ✗ | 27/01/17 |
BaMgF4 | ICSD | 182596 | Ccm2_1 (36) | ✗ | 12 | 96 | 2 | 6.6299 | 6.798 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaAl2(SiO4)2 | ICSD | 191252 | P-3 (147) | ✔ | 13 | 72 | 2 | 4.838 | 4.951 | 0.000 | (0;000) | ✗ | 05/01/17 |
HfP | ICSD | 42914 | P6_3/mmc (194) | ✔ | 8 | 68 | 3 | 0.0 | 0.034 | 0.345 | (1;000) | ✗ | 27/01/17 |
Ba(AlSi)2 | ICSD | 153385 | I4/mmm (139) | ✔ | 5 | 24 | 2 | 0.0 | 0.000 | 0.319 | (1;000) | ✗ | 05/01/17 |
HgO2 | ICSD | 48214 | C2/m (12) | ✔ | 3 | 24 | 3 | 0.8828 | 1.430 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfVP | ICSD | 656389 | Pnma (62) | ✔ | 12 | 120 | 3 | 0.0 | 0.008 | 0.370 | (0;000) | ✗ | 27/01/17 |
HfSiRh | ICSD | 68790 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.001 | 0.538 | (1;011) | ✗ | 27/01/17 |
CaBi2 | ICSD | 659277 | Cmcm (63) | ✔ | 6 | 80 | 1 | 0.0 | 0.032 | 0.360 | (0;110) | ✗ | 05/01/17 |
HfS2 | ICSD | 638847 | P-3m1 (164) | ✔ | 3 | 24 | 2 | 1.0013 | 1.870 | 0.000 | (0;000) | ✗ | 27/01/17 |
HfS3 | ICSD | 638846 | P2_1/m (11) | ✔ | 8 | 60 | 2 | 0.0 | 0.056 | 0.282 | (1;010) | ✗ | 27/01/17 |
HfSb2 | ICSD | 638876 | P4/nmm (129) | ✔ | 6 | 44 | 3 | 0.0 | 0.041 | 0.267 | (1;000) | ✗ | 27/01/17 |
HfSe2 | ICSD | 182678 | P-3m1 (164) | ✔ | 3 | 24 | 2 | 0.0662 | 1.151 | 0.000 | (0;000) | ✗ | 27/01/17 |
HfSiSe | ICSD | 25736 | P4/nmm (129) | ✔ | 6 | 44 | 3 | 0.0 | 0.041 | 0.134 | (0;001) | ✗ | 27/01/17 |
HfSi2 | ICSD | 638917 | Cmcm (63) | ✔ | 6 | 40 | 3 | 0.0 | 0.065 | 0.327 | (1;000) | ✗ | 27/01/17 |
HfSiTe | ICSD | 25737 | P4/nmm (129) | ✔ | 6 | 44 | 2 | 0.0 | 0.031 | 0.167 | (0;001) | ✗ | 27/01/17 |
HfVSi | ICSD | 638931 | P4/nmm (129) | ✔ | 6 | 58 | 3 | 0.0 | 0.000 | 0.815 | (0;000) | ✗ | 27/01/17 |
HfSiS | ICSD | 25735 | P4/nmm (129) | ✔ | 6 | 44 | 3 | 0.0 | 0.101 | 0.125 | (0;001) | ✗ | 27/01/17 |
HfTe2 | ICSD | 603713 | P-3m1 (164) | ✔ | 3 | 24 | 2 | 0.0 | 0.022 | 0.297 | (1;000) | ✗ | 27/01/17 |
BaMgF4 | ICSD | 182597 | Ccm2_1 (36) | ✗ | 12 | 96 | 2 | 7.4872 | 7.496 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfW2 | ICSD | 639012 | Fd-3m (227) | ✔ | 6 | 80 | 3 | 0.0 | 0.000 | 0.639 | (0;000) | ✗ | 27/01/17 |
Ca3(AlGe)2 | ICSD | 52616 | Immm (71) | ✔ | 7 | 44 | 1 | 0.0 | 0.005 | 0.676 | (0;111) | ✗ | 05/01/17 |
Sr(InHg)2 | ICSD | 427211 | I4/mmm (139) | ✔ | 5 | 60 | 3 | 0.0 | 0.032 | 0.716 | (1;000) | ✗ | 27/01/17 |
BaMgF4 | ICSD | 182598 | Ccm2_1 (36) | ✗ | 12 | 96 | 2 | 7.6297 | 7.630 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ca(AlGa)2 | ICSD | 300209 | I4/mmm (139) | ✔ | 5 | 42 | 3 | 0.0 | 0.016 | 0.303 | (0;000) | ✗ | 05/01/17 |