▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Rb2LiVO4 | ICSD | 40218 | Cmc2_1 (36) | ✗ | 16 | 116 | 1 | 3.9707 | 4.042 | 0.000 | (0;000) | ✗ | 29/03/17 |
Na4ReN3 | ICSD | 411243 | Cc (9) | ✗ | 16 | 132 | 1 | 2.236 | 2.312 | 0.000 | (0;000) | ✗ | 29/03/17 |
Ag3AsO4 | COD | 1510036 | P-43n (218) | ✗ | 16 | 124 | 3 | 0.068 | 0.150 | 0.000 | (0;000) | ✔ | 26/04/17 |
Ag3PSe4 | COD | 1510029 | Pmn2_1 (31) | ✗ | 16 | 124 | 3 | 0.0 | 0.028 | 0.178 | ? | ✗ | 04/08/17 |
Zr3Te | ICSD | 81539 | I-4 (82) | ✗ | 16 | 72 | 3 | 0.0 | 0.005 | 0.568 | ? | ✗ | 29/03/17 |
TlTe | COD | 1521987 | I4/mcm (140) | ✔ | 16 | 152 | 3 | 2.2939 | 0.010 | 1.000 | (0;000) | ✗ | 29/03/17 |
Ta3Ge | ICSD | 637967 | I-4 (82) | ✗ | 16 | 172 | 3 | 0.0 | 0.024 | 0.284 | ? | ✗ | 04/08/17 |
RbSbS2 | COD | 1530127 | P1 (1) | ✗ | 16 | 104 | 1 | 1.8665 | 1.867 | 0.000 | (0;000) | ✗ | 29/03/17 |
PdSe | ICSD | 77895 | P4_2/m (84) | ✔ | 16 | 192 | 3 | 0.0 | 0.017 | 0.120 | (0;000) | ✗ | 02/02/17 |
Y3Pd | ICSD | 649111 | Pnma (62) | ✔ | 16 | 204 | 3 | 0.0 | 0.000 | 0.261 | (0;110) | ✗ | 02/02/17 |
SO3 | COD | 9010982 | P2_1/c (14) | ✔ | 16 | 96 | 1 | 5.8568 | 5.878 | 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 |
SbBr3 | ICSD | 27405 | Pnma (62) | ✔ | 16 | 104 | 1 | 2.8677 | 2.983 | 0.000 | (0;000) | ✗ | 02/02/17 |
TiPt3 | ICSD | 649772 | P6_3/mmc (194) | ✔ | 16 | 168 | 3 | 0.0 | 0.005 | 0.276 | (1;000) | ✗ | 02/02/17 |
PdS | COD | 9008964 | P4_2/m (84) | ✔ | 16 | 192 | 3 | 0.0 | 0.012 | 0.455 | (0;000) | ✗ | 02/02/17 |
KSn2Br5 | ICSD | 151983 | I4/mcm (140) | ✔ | 16 | 144 | 2 | 2.2057 | 2.378 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaSiN2 | COD | 4311195 | Cmce (64) | ✔ | 16 | 96 | 1 | 3.0265 | 3.093 | 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 |
Sn3Pd | COD | 1522863 | Cmce (64) | ✔ | 16 | 240 | 3 | 0.0 | 0.014 | 0.604 | (1;000) | ✗ | 02/02/17 |
PdS | COD | 9013399 | P4_2/m (84) | ✔ | 16 | 192 | 3 | 0.0424 | 0.099 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsSn2Br5 | COD | 1525544 | I4/mcm (140) | ✔ | 16 | 144 | 2 | 2.2729 | 2.444 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaNb2V2O11 | ICSD | 165097 | R-3m (166) | ✔ | 16 | 128 | 2 | 2.2681 | 2.270 | 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 |
CsHg2Br5 | COD | 1530529 | P2_1/m (11) | ✔ | 16 | 136 | 1 | 2.1222 | 2.122 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaSO2 | COD | 1524206 | Pnma (62) | ✔ | 16 | 112 | 1 | 0.999 | 1.033 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbSn2Br5 | ICSD | 151989 | I4/mcm (140) | ✔ | 16 | 144 | 2 | 2.2355 | 2.427 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbPb2Br5 | COD | 1010211 | I4/mcm (140) | ✔ | 16 | 144 | 2 | 2.4547 | 2.566 | 0.000 | (0;000) | ✗ | 02/02/17 |
Pb2Br5N | COD | 9016685 | I4/mcm (140) | ✔ | 16 | 136 | 2 | 0.0 | 0.002 | 0.384 | (1;000) | ✗ | 02/02/17 |
Cs4FeO3 | ICSD | 423336 | P-1 (2) | ✔ | 16 | 124 | 3 | 0.0 | 0.006 | 0.144 | (0;000) | ✗ | 02/02/17 |
CsLiF2 | COD | 4343820 | C2/c (15) | ✔ | 16 | 104 | 3 | 6.5835 | 6.584 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsPd2F5 | COD | 1000425 | Imma (74) | ✔ | 16 | 160 | 3 | 0.0 | 0.002 | 0.382 | (0;000) | ✗ | 02/02/17 |
CsNiPdF5 | ICSD | 74288 | Imma (74) | ✔ | 16 | 144 | 3 | 0.0 | 0.002 | 0.251 | (0;111) | ✗ | 02/02/17 |
RbC | ICSD | 51532 | Pnma (62) | ✔ | 16 | 104 | 1 | 3.5711 | 3.623 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrTe2Br5 | ICSD | 69975 | C2/m (12) | ✔ | 16 | 102 | 2 | 1.0371 | 1.115 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlSn2Br5 | ICSD | 151988 | I4/mcm (140) | ✔ | 16 | 152 | 2 | 2.2195 | 2.420 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsGa7 | COD | 1525536 | R-3m (166) | ✔ | 16 | 200 | 3 | 0.0 | 0.038 | 0.400 | (1;111) | ✗ | 02/02/17 |
CsP(HO2)2 | ICSD | 79609 | P2_1/m (11) | ✔ | 16 | 80 | 1 | 5.2962 | 5.388 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiSiNO | ICSD | 34106 | Pca2_1 (29) | ✗ | 16 | 72 | 1 | 5.3934 | 5.555 | 0.000 | (0;000) | ✗ | 15/02/17 |
SiPt3 | ICSD | 77975 | Pnma (62) | ✔ | 16 | 136 | 3 | 0.0 | 0.014 | 0.201 | (0;000) | ✗ | 02/02/17 |
BaGaBO3F2 | ICSD | 91315 | P6_3/m (176) | ✔ | 16 | 116 | 2 | 5.2302 | 5.579 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsTaI6 | ICSD | 418487 | C2/c (15) | ✔ | 16 | 128 | 1 | 0.6727 | 0.680 | 0.000 | (0;000) | ✗ | 02/02/17 |
Fe3C | ICSD | 167667 | Pnma (62) | ✔ | 16 | 112 | 3 | 0.0 | 0.003 | 0.486 | (0;000) | ✗ | 27/01/17 |
Fe3C | COD | 9016182 | Pnma (62) | ✔ | 16 | 112 | 3 | 0.0 | 0.011 | 0.285 | (1;000) | ✗ | 27/01/17 |
Fe3C | ICSD | 29341 | Pnma (62) | ✔ | 16 | 112 | 3 | 0.0 | 0.005 | 0.194 | (1;000) | ✗ | 27/01/17 |
Fe3C | COD | 1010931 | Pnma (62) | ✔ | 16 | 112 | 3 | 0.0 | 0.001 | 0.476 | (1;000) | ✗ | 27/01/17 |
BiF3 | ICSD | 25567 | P-43m (215) | ✗ | 16 | 104 | 3 | 2.8752 | 2.876 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ba5Sn3 | COD | 7221208 | I4/mcm (140) | ✔ | 16 | 184 | 1 | 0.0 | 0.021 | 0.569 | (0;111) | ✗ | 02/02/17 |
TiTlPS5 | COD | 4000515 | P-1 (2) | ✔ | 16 | 120 | 2 | 1.0432 | 1.122 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ba5Bi3 | ICSD | 41839 | P6_3/mcm (193) | ✔ | 16 | 190 | 1 | 0.0 | 0.000 | 0.703 | (1;000) | ✗ | 02/02/17 |
BaSnS2 | ICSD | 2587 | P2_1/c (14) | ✔ | 16 | 144 | 1 | 1.7505 | 1.836 | 0.000 | (0;000) | ✗ | 02/02/17 |