▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
F2 | COD | 9012471 | C2/m (12) | ✔ | 2 | 14 | 1 | 2.5205 | 2.521 | 0.000 | (0;000) | ✗ | 27/01/17 |
SbOF | COD | 1528321 | Pnma (62) | ✔ | 12 | 72 | 1 | 0.0 | 3.503 | 1.000 | (0;000) | ✗ | 27/01/17 |
ScOF | ICSD | 100564 | P2_1/c (14) | ✔ | 12 | 96 | 3 | 4.571 | 4.696 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScOF | COD | 1525435 | P2_1/c (14) | ✔ | 12 | 96 | 3 | 1.0872 | 1.093 | 0.000 | (0;000) | ✗ | 27/01/17 |
YOF | ICSD | 76426 | P4/nmm (129) | ✔ | 6 | 48 | 3 | 2.122 | 2.228 | 0.000 | (0;000) | ✗ | 27/01/17 |
YOF | COD | 2106385 | R-3m (166) | ✔ | 6 | 48 | 3 | 4.9065 | 4.907 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrZnPF | COD | 7203808 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.8953 | 0.895 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbF | COD | 9008708 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 5.7132 | 5.782 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrZnSbF | ICSD | 189935 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.0103 | 0.016 | 0.000 | (0;000) | ✗ | 27/01/17 |
YSF | ICSD | 250885 | P4/nmm (129) | ✔ | 6 | 48 | 3 | 1.2867 | 1.287 | 0.000 | (0;000) | ✗ | 27/01/17 |
TlF | COD | 1010462 | Fmmm (69) | ✔ | 2 | 20 | 2 | 1.7688 | 1.769 | 0.000 | (0;000) | ✗ | 27/01/17 |
TlF | COD | 1520823 | Pbcm (57) | ✔ | 8 | 80 | 2 | 2.8245 | 2.913 | 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 |
GeS2 | ICSD | 167194 | I-42d (122) | ✗ | 6 | 32 | 3 | 2.3808 | 2.735 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiI3 | ICSD | 187607 | P2_1/c (14) | ✔ | 16 | 104 | 2 | 0.6786 | 0.679 | 0.000 | (0;000) | ✗ | 06/10/16 |
MgGa2 | COD | 1523559 | P6_3/mmc (194) | ✔ | 6 | 72 | 3 | 0.0 | 0.005 | 0.510 | (0;000) | ✗ | 27/01/17 |
Mn2Ga2S5 | ICSD | 634664 | P-3m1 (164) | ✔ | 9 | 86 | 2 | 0.0 | 0.000 | 0.324 | (0;000) | ✗ | 27/01/17 |
Nb3Ga2 | COD | 1523839 | P4/mbm (127) | ✔ | 10 | 130 | 3 | 0.0 | 0.000 | 0.851 | (0;000) | ✗ | 27/01/17 |
Ga2NiS4 | ICSD | 634901 | P-3m1 (164) | ✔ | 7 | 60 | 2 | 0.0 | 0.002 | 0.591 | (0;000) | ✗ | 27/01/17 |
ScGa2Ni | COD | 1522446 | Cmcm (63) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.889 | (0;000) | ✗ | 27/01/17 |
YGa2Ni | COD | 1523101 | Cmcm (63) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.900 | (0;000) | ✗ | 27/01/17 |
Ga2O3 | ICSD | 27431 | R-3c (167) | ✔ | 10 | 88 | 3 | 2.8601 | 3.106 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ga2O3 | COD | 1010583 | R-3c (167) | ✔ | 10 | 88 | 3 | 1.8896 | 1.890 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ga2O3 | COD | 2004987 | C2/m (12) | ✔ | 10 | 88 | 3 | 2.4198 | 2.448 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(GaO2)2 | ICSD | 81109 | Fd-3m (227) | ✔ | 14 | 124 | 3 | 2.6084 | 2.793 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ga2TeO6 | ICSD | 78346 | P4_2/mnm (136) | ✔ | 18 | 136 | 3 | 1.3627 | 1.363 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ga2Os | COD | 1522721 | Fddd (70) | ✔ | 6 | 84 | 3 | 0.5627 | 0.794 | 0.000 | (0;000) | ✗ | 27/01/17 |
YInAg2 | COD | 1509655 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.001 | 0.380 | (0;000) | ✗ | 05/01/17 |
Ga2Pt | COD | 9009033 | Fm-3m (225) | ✔ | 3 | 36 | 3 | 0.0 | 0.050 | 0.831 | (0;000) | ✗ | 27/01/17 |
Ga2Ru | ICSD | 635228 | Fddd (70) | ✔ | 6 | 84 | 3 | 0.0567 | 0.830 | 0.000 | (0;000) | ✗ | 27/01/17 |
MgZnAg2 | COD | 1509668 | Fm-3m (225) | ✔ | 4 | 44 | 3 | 0.0 | 0.011 | 0.851 | (0;000) | ✗ | 05/01/17 |
NaAg2 | COD | 1509675 | Fd-3m (227) | ✔ | 6 | 62 | 3 | 0.0 | 0.000 | 0.654 | (0;000) | ✗ | 05/01/17 |
BiI3 | ICSD | 187609 | Fm-3m (225) | ✔ | 4 | 26 | 3 | 0.0 | 0.002 | 0.318 | (0;000) | ✗ | 06/10/16 |
ScSiAu | ICSD | 71998 | P-6m2 (187) | ✗ | 6 | 52 | 3 | 0.0 | 0.035 | 0.194 | (0;000) | ✔ | 06/10/16 |
Ag2PbO2 | COD | 1509690 | C2/c (15) | ✔ | 10 | 96 | 3 | 0.9851 | 1.337 | 0.000 | (0;000) | ✗ | 05/01/17 |
YSiAu | ICSD | 72000 | P6_3mc (186) | ✗ | 6 | 52 | 3 | 0.0 | 0.007 | 0.176 | (0;000) | ✔ | 06/10/16 |
Ag2PdO2 | COD | 1509691 | Immm (71) | ✔ | 5 | 52 | 3 | 0.0 | 0.786 | 0.083 | (0;000) | ✗ | 05/01/17 |
Ag2O3 | COD | 7109247 | Pn-3m (224) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.779 | (0;000) | ✗ | 05/01/17 |
GeSe2 | ICSD | 50761 | I-42d (122) | ✗ | 6 | 32 | 3 | 1.4346 | 1.788 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiI3 | ICSD | 187611 | Pnam (62) | ✔ | 16 | 104 | 3 | 0.0 | 0.026 | 0.642 | (0;000) | ✗ | 06/10/16 |
Ag2SO4 | COD | 1509700 | Fddd (70) | ✔ | 14 | 104 | 3 | 1.3024 | 1.399 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ag2O | COD | 1010604 | Pn-3m (224) | ✔ | 6 | 56 | 3 | 0.0 | 0.003 | 0.004 | (0;000) | ✗ | 05/01/17 |
Ga4GeO8 | COD | 1001682 | C2/m (12) | ✔ | 13 | 104 | 3 | 2.4626 | 2.475 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ga3BN4 | ICSD | 187048 | P-43m (215) | ✗ | 8 | 62 | 3 | 2.5318 | 2.532 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiI3 | ICSD | 56570 | R-3 (148) | ✔ | 8 | 72 | 2 | 1.1573 | 1.189 | 0.000 | (0;000) | ✗ | 06/10/16 |
Zr(TiGa2)2 | ICSD | 635567 | I4/mmm (139) | ✔ | 7 | 80 | 3 | 0.0 | 0.000 | 0.621 | (0;000) | ✗ | 27/01/17 |
GaBN2 | ICSD | 187049 | P-4m2 (115) | ✗ | 4 | 26 | 3 | 3.328 | 3.344 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ag2S | COD | 4329109 | P2_1/c (14) | ✔ | 12 | 112 | 3 | 0.0 | 0.020 | 0.016 | (0;000) | ✗ | 05/01/17 |
GaB3N4 | ICSD | 187050 | P-43m (215) | ✗ | 8 | 42 | 3 | 3.7874 | 3.787 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrAg2 | COD | 1509720 | Imma (74) | ✔ | 6 | 64 | 3 | 0.0 | 0.004 | 0.482 | (0;000) | ✗ | 05/01/17 |
NaGaH4 | ICSD | 67309 | Cmcm (63) | ✔ | 12 | 52 | 1 | 4.9199 | 5.162 | 0.000 | (0;000) | ✗ | 27/01/17 |
AlSb | ICSD | 151218 | F-43m (216) | ✗ | 2 | 8 | 3 | 0.9754 | 1.422 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaHO2 | COD | 8100298 | Pnma (62) | ✔ | 16 | 104 | 3 | 3.5929 | 3.638 | 0.000 | (0;000) | ✗ | 27/01/17 |
InGaO3 | ICSD | 30339 | P6_3/mmc (194) | ✔ | 10 | 88 | 3 | 1.6994 | 1.915 | 0.000 | (0;000) | ✗ | 27/01/17 |
InGaSe2 | ICSD | 601131 | I4/mcm (140) | ✔ | 8 | 76 | 3 | 0.0 | 0.029 | 0.126 | (0;000) | ✗ | 27/01/17 |
GeSe2 | ICSD | 90956 | I-4 (82) | ✗ | 6 | 32 | 3 | 0.9941 | 1.393 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiBeB | ICSD | 191998 | P3m1 (156) | ✗ | 12 | 40 | 1 | 0.2863 | 0.631 | 0.000 | (0;000) | ✔ | 06/10/16 |
LiMg2Ga | COD | 1522013 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.888 | 0.316 | (0;000) | ✗ | 27/01/17 |
LiGaO2 | ICSD | 28388 | R-3m (166) | ✔ | 4 | 28 | 2 | 4.0872 | 4.268 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiGa | COD | 1523146 | Fd-3m (227) | ✔ | 4 | 32 | 3 | 0.0 | 0.013 | 0.218 | (0;000) | ✗ | 27/01/17 |
InAg3(PO4)2 | ICSD | 245001 | C2/m (12) | ✔ | 14 | 104 | 3 | 1.2304 | 1.490 | 0.000 | (0;000) | ✗ | 05/01/17 |
Mn3Ga | ICSD | 634607 | P6_3/mmc (194) | ✔ | 8 | 116 | 3 | 0.0 | 0.001 | 0.680 | (0;000) | ✗ | 27/01/17 |
MnGaNi2 | ICSD | 103803 | Fm-3m (225) | ✔ | 4 | 48 | 3 | 0.0 | 0.000 | 0.609 | (0;000) | ✗ | 27/01/17 |
LiBeB | ICSD | 191999 | Im2m (44) | ✗ | 12 | 40 | 2 | 0.486 | 0.968 | 0.000 | (0;000) | ✔ | 06/10/16 |
MnGaPt | COD | 1523336 | P6_3/mmc (194) | ✔ | 6 | 76 | 3 | 0.0 | 0.001 | 0.576 | (0;000) | ✗ | 27/01/17 |
LiAg3O2 | COD | 7209378 | Ibam (72) | ✔ | 12 | 96 | 3 | 0.7463 | 0.746 | 0.000 | (0;000) | ✗ | 05/01/17 |
Nb3Ga | COD | 1522559 | Pm-3n (223) | ✔ | 8 | 104 | 3 | 0.0 | 0.001 | 0.667 | (0;000) | ✗ | 27/01/17 |
NaAg3O2 | COD | 7209379 | Ibam (72) | ✔ | 12 | 108 | 3 | 0.6845 | 0.685 | 0.000 | (0;000) | ✗ | 05/01/17 |
GaNi2 | ICSD | 634869 | P6_3/mmc (194) | ✔ | 6 | 66 | 3 | 0.0 | 0.000 | 0.978 | (0;000) | ✗ | 27/01/17 |
ScGaNi2 | COD | 1523490 | Fm-3m (225) | ✔ | 4 | 44 | 3 | 0.0 | 0.000 | 0.640 | (0;000) | ✗ | 27/01/17 |
In2Bi | ICSD | 1247 | Ccmm (63) | ✔ | 6 | 62 | 3 | 0.0 | 0.000 | 0.715 | (0;000) | ✗ | 06/10/16 |
K3Bi | ICSD | 26885 | Ccmm (63) | ✔ | 8 | 84 | 1 | 0.0 | 0.006 | 0.037 | (0;000) | ✗ | 06/10/16 |
Ag3Sn | COD | 9011118 | Pmmn (59) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.926 | (0;000) | ✗ | 05/01/17 |
Bi2O3 | ICSD | 168808 | P-4m2 (115) | ✗ | 5 | 28 | 3 | 0.0567 | 0.494 | 0.000 | (0;000) | ✔ | 06/10/16 |
TlGaO2 | ICSD | 33579 | R-3m (166) | ✔ | 8 | 76 | 3 | 1.5136 | 1.563 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2GaSbO6 | ICSD | 157019 | Fm-3m (225) | ✔ | 10 | 74 | 3 | 0.2848 | 0.285 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2TaGaO6 | COD | 2100516 | I4/m (87) | ✔ | 10 | 82 | 3 | 4.0011 | 4.001 | 0.000 | (0;000) | ✗ | 27/01/17 |
Bi2O3 | ICSD | 168810 | R3m (160) | ✗ | 10 | 56 | 2 | 2.2643 | 2.309 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlAgO2 | COD | 1509222 | P6_3/mmc (194) | ✔ | 8 | 52 | 3 | 2.4214 | 2.600 | 0.000 | (0;000) | ✗ | 05/01/17 |
ScGaPd2 | COD | 1523491 | Fm-3m (225) | ✔ | 4 | 60 | 3 | 0.0 | 0.000 | 0.661 | (0;000) | ✗ | 27/01/17 |
GeSe2 | ICSD | 90957 | P-4 (81) | ✗ | 12 | 64 | 3 | 0.7241 | 0.727 | 0.000 | (0;000) | ✔ | 10/10/16 |
AgAsSe2 | COD | 1509200 | R-3m (166) | ✔ | 4 | 28 | 3 | 0.0 | 0.692 | 0.029 | (0;000) | ✗ | 05/01/17 |
TiGaPt | ICSD | 156263 | P6_3/mmc (194) | ✔ | 6 | 70 | 3 | 0.0 | 0.000 | 0.920 | (0;000) | ✗ | 27/01/17 |
AgAuF4 | COD | 4331391 | I4/mcm (140) | ✔ | 12 | 100 | 3 | 1.9268 | 1.932 | 0.000 | (0;000) | ✗ | 05/01/17 |
GaSe | ICSD | 20237 | P6_3/mmc (194) | ✔ | 8 | 76 | 2 | 0.0 | 0.040 | 0.118 | (0;000) | ✗ | 27/01/17 |
GaSe | COD | 9008968 | P6_3/mmc (194) | ✔ | 8 | 76 | 2 | 1.1897 | 1.190 | 0.000 | (0;000) | ✗ | 27/01/17 |
GaS | ICSD | 40824 | R-3m (166) | ✔ | 4 | 38 | 2 | 1.5142 | 1.514 | 0.000 | (0;000) | ✗ | 27/01/17 |
GaS | COD | 9008966 | P6_3/mmc (194) | ✔ | 8 | 76 | 2 | 1.5763 | 1.638 | 0.000 | (0;000) | ✗ | 27/01/17 |
GaS | ICSD | 635254 | P6_3/mmc (194) | ✔ | 8 | 76 | 2 | 1.0343 | 1.618 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ti2Ga | COD | 1522382 | P6_3/mmc (194) | ✔ | 6 | 74 | 3 | 0.0 | 0.000 | 0.878 | (0;000) | ✗ | 27/01/17 |
AgTe2Au | COD | 9003557 | P2/m (10) | ✔ | 8 | 68 | 3 | 0.0 | 0.051 | 0.875 | (0;000) | ✗ | 05/01/17 |
Bi2O3 | ICSD | 168812 | P-42_1c (114) | ✗ | 20 | 112 | 3 | 1.4533 | 1.453 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeTe | ICSD | 159907 | R3m (160) | ✗ | 2 | 10 | 3 | 0.3876 | 0.455 | 0.000 | (0;000) | ✔ | 06/10/16 |
BPO4 | ICSD | 150371 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.5837 | 7.792 | 0.000 | (0;000) | ✗ | 06/10/16 |
BPO4 | ICSD | 150372 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6086 | 7.820 | 0.000 | (0;000) | ✗ | 06/10/16 |
Zn2AgAu | COD | 2310025 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.017 | 0.856 | (0;000) | ✗ | 05/01/17 |
BPO4 | ICSD | 150373 | I-4 (82) | ✗ | 6 | 32 | 3 | 7.6292 | 7.819 | 0.000 | (0;000) | ✗ | 06/10/16 |
In2Ge2O7 | COD | 1530944 | C2/m (12) | ✔ | 11 | 76 | 3 | 2.3152 | 2.315 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaAgSeF | ICSD | 183714 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 1.2151 | 1.215 | 0.000 | (0;000) | ✗ | 05/01/17 |
Sr3Li4(GeN3)2 | ICSD | 96422 | C2/m (12) | ✔ | 15 | 80 | 1 | 2.2416 | 2.435 | 0.000 | (0;000) | ✗ | 27/01/17 |