▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Mg2PN3 | ICSD | 27229 | Cmc2_1 (36) | ✗ | 12 | 80 | 3 | 3.1755 | 3.176 | 0.000 | (0;000) | ✗ | 06/10/16 |
TlSb | ICSD | 184577 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.220 | (0;000) | ✔ | 06/10/16 |
ZrPdF6 | ICSD | 73133 | R-3 (148) | ✔ | 8 | 64 | 3 | 0.0 | 0.000 | 0.785 | (0;000) | ✗ | 27/01/17 |
Mg2PN3 | ICSD | 50224 | Cmc2_1 (36) | ✗ | 12 | 80 | 3 | 3.7075 | 4.301 | 0.000 | (0;000) | ✗ | 06/10/16 |
Nb5N6 | ICSD | 26252 | P6_3/mcm (193) | ✔ | 22 | 190 | 3 | 0.0 | 0.000 | 0.749 | (0;000) | ✗ | 04/08/17 |
P4N6O | ICSD | 79420 | Pnnm (58) | ✔ | 22 | 112 | 3 | 4.74 | 4.924 | 0.000 | (0;000) | ✗ | 04/08/17 |
CaSnO3 | ICSD | 27777 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.000 | 0.845 | (1;111) | ✗ | 27/01/17 |
Ta5N6 | ICSD | 166512 | P6_3/mcm (193) | ✔ | 22 | 190 | 3 | 0.0 | 0.000 | 0.755 | (0;000) | ✗ | 04/08/17 |
NaP4N7 | ICSD | 410629 | C2/c (15) | ✔ | 24 | 128 | 3 | 3.9679 | 4.005 | 0.000 | (0;000) | ✗ | 04/08/17 |
ZnPdF6 | ICSD | 26165 | R-3 (148) | ✔ | 8 | 72 | 3 | 2.1126 | 2.113 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaSnO3 | ICSD | 56095 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 2.8282 | 3.851 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2PtO3 | ICSD | 25020 | Fddd (70) | ✔ | 24 | 184 | 3 | 1.473 | 1.523 | 0.000 | (0;000) | ✗ | 04/08/17 |
Na2RuO3 | COD | 1532912 | C2/c (15) | ✔ | 24 | 208 | 3 | 0.0 | 0.023 | 0.366 | (0;000) | ✗ | 04/08/17 |
MnWN2 | ICSD | 80029 | P6_3mc (186) | ✗ | 8 | 78 | 3 | 0.0 | 0.000 | 0.864 | ? | ✗ | 06/10/16 |
CaTiO3 | ICSD | 162922 | I4/mcm (140) | ✔ | 10 | 80 | 3 | 2.0423 | 2.048 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaTiO3 | COD | 1011211 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 2.033 | 2.432 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2Si3O7 | COD | 9006345 | C2/c (15) | ✔ | 24 | 144 | 3 | 4.9635 | 4.964 | 0.000 | (0;000) | ✗ | 04/08/17 |
ScSi | ICSD | 42946 | Cmcm (63) | ✔ | 4 | 30 | 3 | 0.0 | 0.000 | 0.706 | (0;110) | ✗ | 06/10/16 |
CaZrO3 | COD | 5910140 | Pm-3m (221) | ✔ | 5 | 32 | 3 | 2.8438 | 2.844 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaPd3O4 | COD | 1008075 | Pm-3n (223) | ✔ | 16 | 176 | 3 | 0.0 | 0.004 | 0.120 | (0;000) | ✗ | 27/01/17 |
Ca(PtO2)2 | ICSD | 6159 | P4_2/mmc (131) | ✔ | 14 | 108 | 3 | 0.0 | 0.008 | 0.364 | (1;000) | ✗ | 27/01/17 |
MnNbSi | ICSD | 24185 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.742 | ? | ✗ | 06/10/16 |
ZnSe | ICSD | 162755 | F-43m (216) | ✗ | 2 | 18 | 3 | 1.1452 | 1.145 | 0.000 | (0;000) | ✗ | 06/10/16 |
MnNiP | ICSD | 643091 | P-62m (189) | ✗ | 9 | 90 | 3 | 0.0 | 0.000 | 0.659 | ? | ✗ | 06/10/16 |
CaTl2O4 | COD | 1000379 | Cmcm (63) | ✔ | 14 | 120 | 3 | 0.0168 | 0.077 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaNb3O8 | COD | 9012849 | Ibam (72) | ✔ | 24 | 192 | 3 | 2.3615 | 2.429 | 0.000 | (0;000) | ✗ | 04/08/17 |
NaTa3O8 | COD | 9012848 | Ibam (72) | ✔ | 24 | 192 | 3 | 2.768 | 2.934 | 0.000 | (0;000) | ✗ | 04/08/17 |
CaSi2O5 | COD | 9002042 | C2/c (15) | ✔ | 16 | 96 | 3 | 5.4246 | 5.508 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiMnO3 | ICSD | 184650 | R3c (161) | ✗ | 10 | 90 | 3 | 0.0 | 0.000 | 0.795 | ? | ✗ | 06/10/16 |
CaSiSnO5 | COD | 9006655 | C2/c (15) | ✔ | 16 | 116 | 3 | 3.6012 | 3.668 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaTiSiO5 | COD | 1011220 | C2/c (15) | ✔ | 16 | 112 | 3 | 3.1981 | 3.228 | 0.000 | (0;000) | ✗ | 27/01/17 |
Nb2Se9 | ICSD | 645386 | P-1 (2) | ✔ | 22 | 160 | 3 | 0.6652 | 0.741 | 0.000 | (0;000) | ✗ | 04/08/17 |
Nb3RhSe6 | ICSD | 645284 | P6_322 (182) | ✗ | 20 | 184 | 3 | 0.0 | 0.013 | 0.229 | ? | ✗ | 04/08/17 |
ZrTiF6 | COD | 1532187 | Fm-3m (225) | ✔ | 8 | 58 | 3 | 0.0 | 0.000 | 0.676 | (0;000) | ✗ | 27/01/17 |
NbSbO4 | COD | 1530606 | Pna2_1 (33) | ✗ | 24 | 168 | 3 | 0.0 | 2.791 | 1.000 | ? | ✗ | 04/08/17 |
TiMnO3 | ICSD | 190911 | R3c (161) | ✗ | 10 | 90 | 3 | 0.0 | 0.000 | 0.867 | ? | ✗ | 06/10/16 |
NbPd3 | COD | 2310199 | Pmmn (59) | ✔ | 24 | 402 | 3 | 0.0 | 0.000 | 0.987 | (1;000) | ✗ | 04/08/17 |
NbRh3 | ICSD | 645261 | P6_3/mmc (194) | ✔ | 24 | 384 | 3 | 0.0 | 0.000 | 0.948 | (1;000) | ✗ | 04/08/17 |
NbS3 | ICSD | 645316 | P2_1/m (11) | ✔ | 24 | 186 | 3 | 0.0 | 0.000 | 0.961 | (1;001) | ✗ | 04/08/17 |
SnSe | ICSD | 108293 | Pmmn (59) | ✔ | 8 | 80 | 3 | 0.0 | 0.023 | 0.636 | (0;000) | ✗ | 27/01/17 |
NbSe3 | COD | 1009061 | P2_1/m (11) | ✔ | 24 | 186 | 3 | 0.0 | 0.000 | 0.964 | (0;001) | ✗ | 04/08/17 |
NbZn2 | COD | 2310258 | P6_3/mmc (194) | ✔ | 24 | 296 | 3 | 0.0 | 0.003 | 0.456 | (0;000) | ✗ | 04/08/17 |
Ni2P2O7 | COD | 1007247 | P2_1/c (14) | ✔ | 22 | 144 | 3 | 0.0 | 0.006 | 0.562 | (1;010) | ✗ | 04/08/17 |
Rb3NiO2 | ICSD | 424580 | P4_12_12 (92) | ✗ | 24 | 196 | 3 | 0.0 | 0.000 | 0.752 | ? | ✗ | 04/08/17 |
Re2NiO8 | ICSD | 51016 | P-3 (147) | ✔ | 11 | 88 | 3 | 0.0 | 0.000 | 0.600 | (0;000) | ✗ | 04/08/17 |
Fe3H4(OF4)2 | ICSD | 37140 | C2/m (12) | ✔ | 17 | 96 | 3 | 0.0 | 0.055 | 0.380 | (0;111) | ✗ | 27/01/17 |
Ni2W3N | ICSD | 86170 | P4_132 (213) | ✗ | 24 | 436 | 3 | 0.0 | 0.000 | 0.578 | ? | ✗ | 04/08/17 |
TiMnO3 | ICSD | 65359 | R3c (161) | ✗ | 10 | 90 | 3 | 0.0 | 0.000 | 0.700 | ? | ✗ | 06/10/16 |
ZnSnF6 | ICSD | 25012 | R-3 (148) | ✔ | 8 | 68 | 3 | 2.9957 | 3.013 | 0.000 | (0;000) | ✗ | 27/01/17 |
V3Zn2N | ICSD | 644866 | P4_132 (213) | ✗ | 24 | 272 | 3 | 0.0 | 0.026 | 0.128 | ? | ✗ | 04/08/17 |