▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
CrPSe3 | ICSD | 626521 | C2/m (12) | ✔ | 10 | 74 | 2 | 0.0 | 0.007 | 0.417 | (0;001) | ✗ | 02/02/17 |
CrSbS3 | ICSD | 74601 | Pnma (62) | ✔ | 20 | 148 | 3 | 0.0 | 0.000 | 0.225 | (0;011) | ✗ | 02/02/17 |
CrSbSe3 | ICSD | 84866 | Pnma (62) | ✔ | 20 | 148 | 3 | 0.0 | 0.000 | 0.503 | (0;011) | ✗ | 02/02/17 |
CrSiTe3 | ICSD | 626810 | R-3 (148) | ✔ | 10 | 72 | 2 | 0.0 | 0.030 | 0.030 | (1;111) | ✗ | 02/02/17 |
SiO2 | ICSD | 75654 | C2/c (15) | ✔ | 12 | 64 | 3 | 5.8229 | 5.859 | 0.000 | (0;000) | ✗ | 06/10/16 |
CS14 | ICSD | 26464 | R-3m (166) | ✔ | 15 | 88 | 2 | 2.3303 | 2.487 | 0.000 | (0;000) | ✗ | 02/02/17 |
IrW | ICSD | 104596 | Pmmb (51) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.746 | (0;001) | ✗ | 06/10/16 |
Cs2TeOF4 | ICSD | 411626 | Cmcm (63) | ✔ | 16 | 116 | 1 | 5.2321 | 5.241 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2NaGaF6 | ICSD | 55003 | R-3m (166) | ✔ | 20 | 164 | 1 | 6.4731 | 6.496 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2KYF6 | ICSD | 155977 | Fm-3m (225) | ✔ | 10 | 80 | 1 | 6.8517 | 6.852 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2RbYF6 | ICSD | 25366 | Fm-3m (225) | ✔ | 10 | 80 | 1 | 6.5182 | 6.528 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2VF6 | ICSD | 6041 | Cmcm (63) | ✔ | 18 | 146 | 1 | 0.0 | 0.000 | 0.899 | (1;110) | ✗ | 02/02/17 |
Cs2K4Fe2O5 | ICSD | 65942 | C2/m (12) | ✔ | 13 | 100 | 1 | 0.0 | 0.012 | 0.098 | (0;000) | ✗ | 02/02/17 |
Cs2Li3GaO4 | ICSD | 69491 | Ibam (72) | ✔ | 20 | 128 | 2 | 4.0292 | 4.029 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Li2GeO4 | ICSD | 36532 | P-1 (2) | ✔ | 18 | 104 | 2 | 3.9221 | 4.022 | 0.000 | (0;000) | ✗ | 02/02/17 |
GaPO4 | ICSD | 97550 | C222_1 (20) | ✗ | 12 | 84 | 3 | 4.5581 | 4.558 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cs2GeSe3 | ICSD | 415215 | C2/m (12) | ✔ | 12 | 80 | 1 | 1.7854 | 1.887 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2GeSe4 | ICSD | 74832 | C2/m (12) | ✔ | 14 | 92 | 1 | 1.7325 | 1.812 | 0.000 | (0;000) | ✗ | 02/02/17 |
BeH2 | ICSD | 161367 | Ibam (72) | ✔ | 18 | 36 | 1 | 5.4829 | 5.483 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cs2Sn2Hg3S8 | ICSD | 85598 | P-1 (2) | ✔ | 15 | 130 | 1 | 1.743 | 1.786 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Li3I5 | ICSD | 35655 | C2/m (12) | ✔ | 10 | 62 | 1 | 3.703 | 3.703 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrGaRh | ICSD | 635225 | P-62m (189) | ✗ | 9 | 102 | 3 | 0.0 | 0.000 | 0.743 | ? | ✗ | 06/10/16 |
HfBeSi | ICSD | 108103 | P6_3/mmc (194) | ✔ | 6 | 40 | 3 | 0.0 | 0.001 | 0.140 | (1;000) | ✗ | 05/01/17 |
LiBeN | ICSD | 402341 | P2_1/c (14) | ✔ | 12 | 48 | 1 | 2.7254 | 2.963 | 0.000 | (0;000) | ✗ | 05/01/17 |
ZrIr | ICSD | 163453 | Cmcm (63) | ✔ | 8 | 84 | 3 | 0.0 | 0.017 | 0.492 | (1;000) | ✗ | 27/01/17 |
Cs2TeI6 | ICSD | 38105 | Fm-3m (225) | ✔ | 9 | 66 | 2 | 1.0948 | 1.391 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Na2IrO4 | ICSD | 71624 | C2/m (12) | ✔ | 18 | 154 | 3 | 0.0 | 0.019 | 0.258 | (0;110) | ✗ | 02/02/17 |
Cs2Li2SiO4 | ICSD | 33809 | P-1 (2) | ✔ | 18 | 104 | 2 | 4.1815 | 4.319 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Li2TiO4 | ICSD | 33810 | P-1 (2) | ✔ | 18 | 120 | 2 | 4.2643 | 4.371 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2LiNbS4 | ICSD | 414187 | P-1 (2) | ✔ | 16 | 116 | 1 | 2.4841 | 2.594 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2MnS2 | ICSD | 65455 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.342 | (1;101) | ✗ | 02/02/17 |
Cs2MnSe2 | ICSD | 65458 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.325 | (1;001) | ✗ | 02/02/17 |
Cs2MnTe2 | ICSD | 65461 | Ibam (72) | ✔ | 10 | 90 | 1 | 0.0 | 0.000 | 0.301 | (1;001) | ✗ | 02/02/17 |
Cs2Mo(SO)2 | ICSD | 423982 | C2/c (15) | ✔ | 14 | 112 | 1 | 2.3707 | 2.532 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2NaVO4 | ICSD | 65963 | P2_1/m (11) | ✔ | 16 | 128 | 1 | 3.9489 | 4.047 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Ni3S4 | ICSD | 627055 | Fmmm (69) | ✔ | 9 | 72 | 2 | 0.3986 | 0.478 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Ni3S4 | ICSD | 63010 | P6_3/mmc (194) | ✔ | 18 | 144 | 1 | 0.8774 | 0.984 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Ni3Se4 | ICSD | 33891 | Fmmm (69) | ✔ | 9 | 72 | 1 | 0.6 | 0.806 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2NiP2 | ICSD | 656056 | Cmcm (63) | ✔ | 10 | 76 | 2 | 0.0 | 0.006 | 0.149 | (0;000) | ✗ | 02/02/17 |
Cs2SrV4O12 | ICSD | 250106 | P4/mmm (123) | ✔ | 19 | 152 | 1 | 2.6877 | 2.688 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2PbO3 | ICSD | 62140 | Cmcm (63) | ✔ | 12 | 100 | 2 | 1.7632 | 1.763 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2ZrO3 | ICSD | 67345 | Cmcm (63) | ✔ | 12 | 80 | 2 | 3.7167 | 3.717 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2P2Pt | ICSD | 658699 | Cmcm (63) | ✔ | 10 | 76 | 2 | 0.0 | 0.201 | 0.046 | (0;000) | ✗ | 02/02/17 |
Ga2HgS4 | ICSD | 67220 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7231 | 1.723 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cs2P3 | ICSD | 65185 | Fmmm (69) | ✔ | 10 | 66 | 1 | 0.8432 | 0.843 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Pd3S4 | ICSD | 26250 | C2/m (12) | ✔ | 9 | 96 | 1 | 1.4138 | 1.552 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Pd3Se4 | ICSD | 33892 | Fmmm (69) | ✔ | 9 | 96 | 1 | 1.0442 | 1.135 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Sb2Pd | ICSD | 658702 | Cmcm (63) | ✔ | 10 | 92 | 3 | 0.6383 | 0.788 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2PSe5 | ICSD | 418434 | P-1 (2) | ✔ | 16 | 106 | 1 | 1.52 | 1.622 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Pt3S4 | ICSD | 26266 | Fmmm (69) | ✔ | 9 | 72 | 1 | 1.1613 | 1.421 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Pt3Se4 | ICSD | 33893 | Fmmm (69) | ✔ | 9 | 72 | 1 | 1.2542 | 1.348 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Pt | ICSD | 413241 | P6_3/mmc (194) | ✔ | 6 | 56 | 2 | 1.2769 | 1.369 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Sb2Pt | ICSD | 658700 | Cmcm (63) | ✔ | 10 | 76 | 3 | 0.687 | 0.891 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Te2Pt | ICSD | 627076 | Immm (71) | ✔ | 5 | 40 | 1 | 0.7283 | 0.972 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2SiS3 | ICSD | 409176 | C2/m (12) | ✔ | 12 | 80 | 1 | 3.0578 | 3.089 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2SnSe3 | ICSD | 67251 | C2/m (12) | ✔ | 12 | 100 | 1 | 1.7375 | 1.738 | 0.000 | (0;000) | ✗ | 02/02/17 |
BeMo3 | ICSD | 58715 | Pm-3n (223) | ✔ | 8 | 92 | 3 | 0.0 | 0.008 | 0.403 | (0;000) | ✗ | 05/01/17 |
Hf6Ga2Ni | ICSD | 634312 | P-62m (189) | ✗ | 9 | 108 | 3 | 0.0 | 0.000 | 0.890 | ? | ✗ | 06/10/16 |
Cs2Se | ICSD | 627099 | Pnma (62) | ✔ | 12 | 96 | 1 | 2.0773 | 2.077 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2S | ICSD | 27463 | P6_3/mmc (194) | ✔ | 6 | 48 | 1 | 1.3455 | 1.346 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsSnS3 | ICSD | 73008 | P-1 (2) | ✔ | 10 | 82 | 1 | 1.838 | 1.955 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaSb2 | ICSD | 409517 | P2_1/m (11) | ✔ | 6 | 40 | 1 | 0.0 | 0.056 | 0.102 | (0;001) | ✔ | 04/10/16 |
Cs2Te5 | ICSD | 36017 | Cmcm (63) | ✔ | 14 | 96 | 1 | 0.2901 | 0.290 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2Te | ICSD | 36501 | Pnma (62) | ✔ | 12 | 96 | 1 | 1.8757 | 1.876 | 0.000 | (0;000) | ✗ | 02/02/17 |
CrTe | ICSD | 169766 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.024 | 0.243 | (1;000) | ✔ | 04/10/16 |
AgCl | ICSD | 56541 | P2_1/m (11) | ✔ | 4 | 36 | 3 | 0.6845 | 2.523 | 0.000 | (0;000) | ✗ | 06/10/16 |
CrBr2 | ICSD | 23903 | C2/m (12) | ✔ | 3 | 28 | 2 | 0.0 | 0.045 | 0.565 | (0;000) | ✔ | 27/01/17 |
Cs3MnI5 | ICSD | 403102 | I4/mcm (140) | ✔ | 18 | 154 | 1 | 0.0 | 0.000 | 0.298 | (0;111) | ✗ | 02/02/17 |
CaF2 | ICSD | 51239 | Pmc2_1 (26) | ✗ | 6 | 48 | 1 | 6.5997 | 6.813 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cs3NiO2 | ICSD | 424578 | P4_2/mnm (136) | ✔ | 12 | 98 | 3 | 0.0 | 0.000 | 0.766 | (0;000) | ✗ | 02/02/17 |
SiO2 | ICSD | 75657 | C2 (5) | ✗ | 12 | 64 | 3 | 5.553 | 5.591 | 0.000 | (0;000) | ✗ | 06/10/16 |
Tl2CS3 | ICSD | 420223 | C2/c (15) | ✔ | 12 | 96 | 1 | 1.4572 | 1.600 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs4FeO3 | ICSD | 423336 | P-1 (2) | ✔ | 16 | 124 | 3 | 0.0 | 0.006 | 0.144 | (0;000) | ✗ | 02/02/17 |
Cs6Fe2O5 | ICSD | 73134 | C2/m (12) | ✔ | 13 | 100 | 3 | 0.0 | 0.017 | 0.390 | (0;000) | ✗ | 02/02/17 |
Cs6GaSb3 | ICSD | 300216 | P2_1/m (11) | ✔ | 20 | 164 | 1 | 0.7326 | 0.805 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2O2 | ICSD | 180559 | Ccme (64) | ✔ | 8 | 60 | 1 | 2.5679 | 2.644 | 0.000 | (0;000) | ✗ | 06/10/16 |
Zr5Sb3C | ICSD | 618767 | P6_3/mcm (193) | ✔ | 18 | 78 | 3 | 0.0 | 0.000 | 0.884 | (1;000) | ✗ | 02/02/17 |
CsCu2F6 | ICSD | 62032 | Imma (74) | ✔ | 18 | 146 | 3 | 0.0 | 0.002 | 0.256 | (1;101) | ✗ | 02/02/17 |
CsCu2I3 | ICSD | 150305 | Cmcm (63) | ✔ | 12 | 104 | 1 | 1.9026 | 1.903 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsSc3(CuTe3)2 | ICSD | 417411 | C2/m (12) | ✔ | 12 | 100 | 3 | 0.0 | 0.319 | 0.067 | (0;000) | ✗ | 02/02/17 |
CsTiCu3Se4 | ICSD | 391259 | P2_1/m (11) | ✔ | 18 | 156 | 2 | 1.2556 | 1.438 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ga2HgS4 | ICSD | 189737 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7261 | 1.726 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsCuF4 | ICSD | 35264 | I4/mcm (140) | ✔ | 12 | 96 | 3 | 1.5647 | 1.629 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrBeSi | ICSD | 76123 | P6_3/mmc (194) | ✔ | 6 | 24 | 3 | 0.0 | 0.006 | 0.162 | (1;000) | ✗ | 05/01/17 |
Ga2HgS4 | ICSD | 189738 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.6944 | 1.694 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsMoO2F3 | ICSD | 9710 | Imma (74) | ✔ | 14 | 112 | 1 | 3.4674 | 3.490 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsNiF3 | ICSD | 410393 | R-3m (166) | ✔ | 15 | 120 | 3 | 0.0 | 0.015 | 0.438 | (0;111) | ✗ | 02/02/17 |
CsSnF3 | ICSD | 236903 | P2_1/c (14) | ✔ | 20 | 176 | 1 | 3.7279 | 3.733 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsK2PdF5 | ICSD | 72301 | P4/mbm (127) | ✔ | 18 | 160 | 2 | 2.2574 | 2.261 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsNiPdF5 | ICSD | 74288 | Imma (74) | ✔ | 16 | 144 | 3 | 0.0 | 0.002 | 0.251 | (0;111) | ✗ | 02/02/17 |
CsOsNOF5 | ICSD | 166587 | P2_1/m (11) | ✔ | 18 | 142 | 1 | 0.0 | 0.000 | 0.670 | (0;000) | ✗ | 02/02/17 |
Ta2Be | ICSD | 58738 | I4/mcm (140) | ✔ | 6 | 60 | 3 | 0.0 | 0.005 | 0.340 | (1;000) | ✗ | 05/01/17 |
CsRb2PdF5 | ICSD | 35286 | P4/mbm (127) | ✔ | 18 | 160 | 1 | 2.3602 | 2.364 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3Sb | ICSD | 641351 | Fm-3m (225) | ✔ | 4 | 32 | 1 | 0.6121 | 0.612 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsNi2F6 | ICSD | 31780 | Imma (74) | ✔ | 18 | 142 | 3 | 0.0 | 0.002 | 0.528 | (0;101) | ✗ | 02/02/17 |
CsHIF7 | ICSD | 71581 | P-1 (2) | ✔ | 20 | 132 | 1 | 4.706 | 4.783 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ga2HgS4 | ICSD | 189739 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7259 | 1.726 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsReF8 | ICSD | 410829 | P4/nmm (129) | ✔ | 20 | 160 | 1 | 2.0109 | 2.046 | 0.000 | (0;000) | ✗ | 02/02/17 |
BH3NF4 | ICSD | 49614 | P-1 (2) | ✔ | 18 | 78 | 1 | 7.5408 | 7.573 | 0.000 | (0;000) | ✗ | 05/01/17 |
CsFe2Se3 | ICSD | 187535 | Cmcm (63) | ✔ | 12 | 86 | 1 | 0.0 | 0.000 | 0.229 | (0;000) | ✗ | 02/02/17 |