▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
BiPO4 | COD | 9008088 | P3_121 (152) | ✗ | 18 | 132 | 3 | 3.0778 | 3.125 | 0.000 | (0;000) | ✗ | 21/03/17 |
CaSn2F6 | COD | 1526708 | P-1 (2) | ✔ | 18 | 160 | 1 | 3.5254 | 3.609 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaAs2 | ICSD | 414139 | Pc (7) | ✗ | 18 | 120 | 1 | 0.3452 | 0.346 | 0.000 | (0;000) | ✔ | 24/04/17 |
Zr5CuBi3 | COD | 2238336 | P6_3/mcm (193) | ✔ | 18 | 152 | 3 | 0.0 | 0.001 | 0.632 | (0;000) | ✗ | 02/02/17 |
Al5C3N | COD | 2310415 | P6_3mc (186) | ✗ | 18 | 64 | 3 | 0.0 | 0.726 | 0.092 | (0;000) | ✔ | 24/04/17 |
KCu2P2H3(O4F)2 | ICSD | 62646 | C2/m (12) | ✔ | 18 | 106 | 3 | 0.0 | 0.017 | 0.015 | (0;001) | ✗ | 27/01/17 |
LiCaNiF6 | ICSD | 32732 | P-31c (163) | ✔ | 18 | 130 | 1 | 0.0 | 0.000 | 0.767 | (0;000) | ✗ | 02/02/17 |
Fe(SbO3)2 | ICSD | 40344 | P4_2/mnm (136) | ✔ | 18 | 108 | 3 | 0.0 | 0.012 | 0.041 | (0;000) | ✗ | 27/01/17 |
LiCaGaF6 | ICSD | 152300 | P-31c (163) | ✔ | 18 | 136 | 2 | 5.5593 | 5.621 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Cd3Te4 | COD | 1521662 | Ibam (72) | ✔ | 18 | 156 | 2 | 1.5731 | 1.573 | 0.000 | (0;000) | ✗ | 22/03/17 |
Sc(ReO3)2 | ICSD | 245796 | P2_1/c (14) | ✔ | 18 | 154 | 3 | 0.0 | 0.000 | 0.679 | (0;110) | ✗ | 02/02/17 |
K2Al2O3F2 | ICSD | 421736 | C2/m (12) | ✔ | 18 | 112 | 2 | 4.135 | 4.135 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ca3(AlP2)2 | ICSD | 423780 | C2/c (15) | ✔ | 18 | 112 | 2 | 1.257 | 1.257 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ca3(AlN2)2 | COD | 4321679 | C2/c (15) | ✔ | 18 | 112 | 2 | 2.5001 | 2.500 | 0.000 | (0;000) | ✗ | 30/01/17 |
FeTeBr7 | ICSD | 39531 | P1 (1) | ✗ | 18 | 126 | 2 | 0.0 | 0.004 | 0.497 | ? | ✗ | 21/03/17 |
Zr5GaSn3 | COD | 4002358 | P6_3/mcm (193) | ✔ | 18 | 150 | 3 | 0.0 | 0.000 | 0.788 | (1;000) | ✗ | 02/02/17 |
Pb(SeO3)2 | ICSD | 154718 | P2_1/c (14) | ✔ | 18 | 124 | 3 | 1.9558 | 2.355 | 0.000 | (0;000) | ✗ | 02/02/17 |
Al2Fe3Si4 | COD | 2005762 | Cmcm (63) | ✔ | 18 | 92 | 3 | 0.0 | 0.013 | 0.933 | (0;000) | ✗ | 30/01/17 |
Sr(BrO3)2 | ICSD | 61158 | Cc (9) | ✗ | 18 | 120 | 1 | 4.2156 | 4.324 | 0.000 | (0;000) | ✗ | 21/03/17 |
In6Ge2PtO9 | ICSD | 170897 | Fm-3m (225) | ✔ | 18 | 150 | 3 | 1.6147 | 1.767 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li7Ge2 | ICSD | 42063 | Cmmm (65) | ✔ | 18 | 58 | 1 | 0.0 | 0.014 | 0.639 | (0;000) | ✗ | 02/02/17 |
Cs3CdBr5 | ICSD | 39599 | I4/mcm (140) | ✔ | 18 | 148 | 1 | 3.1932 | 3.193 | 0.000 | (0;000) | ✗ | 21/03/17 |
Ta2O7 | COD | 9014281 | Fd-3m (227) | ✔ | 18 | 136 | 3 | 0.0 | 0.000 | 0.488 | (0;000) | ✗ | 02/02/17 |
FeSeBr7 | ICSD | 39528 | Pc (7) | ✗ | 18 | 126 | 1 | 0.0 | 0.000 | 0.345 | (0;100) | ✔ | 21/03/17 |
GaSeBr7 | COD | 8101317 | Pc (7) | ✗ | 18 | 136 | 1 | 2.2271 | 2.259 | 0.000 | (0;000) | ✗ | 21/03/17 |
Cs2LiAl3F12 | COD | 1000165 | R-3m (166) | ✔ | 18 | 114 | 1 | 6.8333 | 6.936 | 0.000 | (0;000) | ✗ | 30/01/17 |
Al3(BRu2)2 | ICSD | 43844 | P4/mmm (123) | ✔ | 18 | 158 | 3 | 0.0 | 0.002 | 0.844 | (1;110) | ✗ | 30/01/17 |
P3BrCl14 | ICSD | 80214 | I4 (79) | ✗ | 18 | 120 | 1 | 1.8798 | 1.958 | 0.000 | (0;000) | ✗ | 21/03/17 |
Nb4B3C2 | ICSD | 411623 | Cmcm (63) | ✔ | 18 | 138 | 3 | 0.0 | 0.000 | 0.957 | (0;110) | ✗ | 21/03/17 |
Cs2NaAl3F12 | COD | 1000164 | R-3m (166) | ✔ | 18 | 120 | 3 | 0.4217 | 0.565 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ba2In2O5 | COD | 1522063 | Ima2 (46) | ✗ | 18 | 152 | 3 | 0.0 | 0.007 | 0.243 | (0;111) | ✔ | 26/04/17 |
AgC2N3 | ICSD | 843 | P3_121 (152) | ✗ | 18 | 102 | 3 | 3.4019 | 3.423 | 0.000 | (0;000) | ✗ | 21/03/17 |
Al5C3N | COD | 1010635 | P6_3mc (186) | ✗ | 18 | 64 | 3 | 0.176 | 1.164 | 0.000 | (0;000) | ✔ | 26/04/17 |
Hf5Al3N | ICSD | 603995 | P6_3/mcm (193) | ✔ | 18 | 148 | 3 | 0.0 | 0.006 | 0.541 | (1;000) | ✗ | 30/01/17 |
Cs2NaAl3F12 | COD | 1000492 | R-3m (166) | ✔ | 18 | 120 | 1 | 7.3545 | 7.371 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ba4LiCu(CO5)2 | COD | 2002734 | I-42m (121) | ✗ | 18 | 122 | 2 | 1.1212 | 1.566 | 0.000 | (0;000) | ✗ | 21/03/17 |
Ba4NaCu(CO5)2 | ICSD | 80606 | I-42m (121) | ✗ | 18 | 128 | 1 | 1.1718 | 1.606 | 0.000 | (0;000) | ✗ | 21/03/17 |
C4SBr4 | COD | 2102931 | Pc (7) | ✗ | 18 | 100 | 1 | 2.3353 | 2.485 | 0.000 | (0;000) | ✗ | 21/03/17 |
Zr5Al4 | ICSD | 191012 | P6_3/mcm (193) | ✔ | 18 | 64 | 3 | 0.0 | 0.000 | 0.685 | (1;000) | ✗ | 30/01/17 |
Zn(SbO3)2 | COD | 9012739 | P4_2/mnm (136) | ✔ | 18 | 116 | 3 | 0.9854 | 1.087 | 0.000 | (0;000) | ✗ | 02/02/17 |
Mg2Al4Zn3 | ICSD | 180365 | P6_3/mmc (194) | ✔ | 18 | 136 | 3 | 0.0 | 0.018 | 0.743 | (1;000) | ✗ | 30/01/17 |
Ba4Al5 | ICSD | 420091 | P6_3/mmc (194) | ✔ | 18 | 110 | 1 | 0.0 | 0.000 | 0.599 | (0;000) | ✗ | 30/01/17 |
AgCS(OF)3 | ICSD | 183643 | R-3 (148) | ✔ | 18 | 120 | 2 | 2.8132 | 3.334 | 0.000 | (0;000) | ✗ | 02/02/17 |
Al4SiC4 | ICSD | 606255 | P6_3mc (186) | ✗ | 18 | 64 | 3 | 0.0 | 0.002 | 0.493 | ? | ✗ | 21/03/17 |
K2B(CN)3 | ICSD | 262588 | Fdd2 (43) | ✗ | 18 | 96 | 1 | 2.5094 | 2.511 | 0.000 | (0;000) | ✗ | 21/03/17 |
NaCr2In(H2O5)2 | COD | 2015315 | C2/m (12) | ✔ | 18 | 114 | 3 | 2.8092 | 2.828 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sn(SeO3)2 | ICSD | 154717 | P2_1/c (14) | ✔ | 18 | 124 | 3 | 3.5691 | 3.902 | 0.000 | (0;000) | ✗ | 02/02/17 |
HfGePd | ICSD | 418027 | P2_1/m (11) | ✔ | 18 | 204 | 3 | 0.0 | 0.016 | 0.257 | (1;000) | ✗ | 02/02/17 |
Tl2C3O4 | ICSD | 260372 | C2 (5) | ✗ | 18 | 124 | 3 | 0.6959 | 0.021 | 1.000 | (0;000) | ✗ | 21/03/17 |
C5N4 | ICSD | 2130 | R3c (161) | ✗ | 18 | 80 | 3 | 6.2909 | 6.303 | 0.000 | (0;000) | ✗ | 21/03/17 |