▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cd3TeO6 | ICSD | 35084 | P2_1/c (14) | ✔ | 20 | 156 | 3 | 0.8176 | 0.818 | 0.000 | (0;000) | ✗ | 02/02/17 |
VCu3S4 | ICSD | 36298 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.0298 | 1.388 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ba(NiP2)2 | ICSD | 79105 | I4/mmm (139) | ✔ | 7 | 50 | 2 | 0.0 | 0.004 | 0.466 | (0;000) | ✗ | 05/01/17 |
VCu3S4 | ICSD | 402891 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.0094 | 1.363 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaNiO2 | COD | 1527692 | Cmcm (63) | ✔ | 8 | 64 | 2 | 0.0 | 0.025 | 0.027 | (0;000) | ✗ | 05/01/17 |
KCdCl3 | ICSD | 33281 | Pnma (62) | ✔ | 20 | 168 | 2 | 3.676 | 3.816 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdNCl3 | COD | 9014544 | Pnma (62) | ✔ | 20 | 152 | 2 | 0.0 | 0.005 | 0.361 | (0;000) | ✗ | 02/02/17 |
RbCdCl3 | COD | 1530478 | Pnma (62) | ✔ | 20 | 168 | 1 | 3.7589 | 3.876 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlCdCl3 | ICSD | 39807 | Pnma (62) | ✔ | 20 | 184 | 2 | 2.8952 | 2.896 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2CdCl4 | COD | 2310671 | I4/mmm (139) | ✔ | 7 | 58 | 2 | 3.4013 | 3.913 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na2CdCl4 | ICSD | 69344 | Pbam (55) | ✔ | 14 | 116 | 1 | 3.5843 | 3.600 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2CdCl4 | ICSD | 51168 | I4/mmm (139) | ✔ | 7 | 58 | 2 | 3.2651 | 3.747 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na6CdCl8 | ICSD | 35070 | Fm-3m (225) | ✔ | 15 | 122 | 2 | 3.4215 | 3.422 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSbS2Cl | ICSD | 171722 | Pnma (62) | ✔ | 20 | 144 | 3 | 1.54 | 1.566 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiCdCoF6 | ICSD | 32731 | P-31c (163) | ✔ | 18 | 148 | 3 | 1.2028 | 1.205 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2Cr2Cd(H2O5)2 | ICSD | 162408 | P-1 (2) | ✔ | 19 | 122 | 2 | 2.7697 | 2.951 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cr2CdS4 | ICSD | 657592 | Fd-3m (227) | ✔ | 14 | 128 | 3 | 0.0 | 0.012 | 0.195 | (0;000) | ✗ | 02/02/17 |
Cr2CdSe4 | COD | 9012053 | Fd-3m (227) | ✔ | 14 | 128 | 3 | 0.0 | 0.007 | 0.094 | (0;000) | ✗ | 02/02/17 |
Cs2CdI4 | COD | 1518204 | P2_1/m (11) | ✔ | 14 | 116 | 1 | 2.7112 | 2.711 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsYCdSe3 | COD | 4313788 | Cmcm (63) | ✔ | 12 | 100 | 1 | 2.1463 | 2.153 | 0.000 | (0;000) | ✗ | 02/02/17 |
KCdF3 | COD | 1530090 | Pnma (62) | ✔ | 20 | 168 | 3 | 3.3039 | 3.304 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbZrCdF7 | ICSD | 245783 | Cmcm (63) | ✔ | 20 | 148 | 3 | 5.4062 | 5.487 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrTlCdF7 | ICSD | 245784 | Cmcm (63) | ✔ | 20 | 156 | 3 | 4.8717 | 4.872 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdInGaS4 | ICSD | 20785 | P-3m1 (164) | ✔ | 14 | 124 | 1 | 0.0 | 0.001 | 0.124 | (0;000) | ✗ | 02/02/17 |
ZnO | ICSD | 162753 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.6019 | 0.602 | 0.000 | (0;000) | ✗ | 06/10/16 |
CdGeO3 | COD | 1530775 | C2/c (15) | ✔ | 20 | 136 | 3 | 1.7048 | 1.761 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdGeO3 | COD | 9005881 | Pnma (62) | ✔ | 20 | 136 | 3 | 1.2811 | 1.281 | 0.000 | (0;000) | ✗ | 02/02/17 |
HfS2 | ICSD | 601164 | P-3m1 (164) | ✔ | 3 | 24 | 2 | 0.9936 | 1.854 | 0.000 | (0;000) | ✗ | 06/10/16 |
CdHg2SeO6 | ICSD | 413288 | P-1 (2) | ✔ | 20 | 156 | 3 | 1.2137 | 1.289 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdHg2SO6 | ICSD | 413287 | P-1 (2) | ✔ | 20 | 156 | 3 | 1.5314 | 1.669 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdI2 | ICSD | 108924 | P-3m1 (164) | ✔ | 15 | 130 | 1 | 1.9801 | 2.176 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdI2 | ICSD | 20745 | P-3m1 (164) | ✔ | 9 | 78 | 1 | 1.9108 | 2.098 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdI2 | ICSD | 42257 | P-3m1 (164) | ✔ | 18 | 156 | 1 | 1.9559 | 2.171 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdI2 | ICSD | 42312 | P-3m1 (164) | ✔ | 18 | 156 | 1 | 1.9865 | 2.173 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdI2 | ICSD | 6066 | P-3m1 (164) | ✔ | 18 | 156 | 1 | 1.9709 | 2.171 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlCdI3 | ICSD | 8009 | Pnma (62) | ✔ | 20 | 184 | 2 | 1.8407 | 1.934 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdI2 | ICSD | 9190 | P-3m1 (164) | ✔ | 12 | 104 | 1 | 1.9523 | 2.170 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSb6(S2I)4 | ICSD | 27733 | P-1 (2) | ✔ | 19 | 118 | 1 | 1.4312 | 1.431 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd(InS2)2 | COD | 9012323 | Fd-3m (227) | ✔ | 14 | 124 | 3 | 1.4147 | 1.507 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd(InSe2)2 | ICSD | 52811 | Fd-3m (227) | ✔ | 14 | 124 | 3 | 0.2271 | 0.316 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2CdN12 | ICSD | 31297 | C2/m (12) | ✔ | 15 | 90 | 1 | 2.9481 | 2.992 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2CdN12 | ICSD | 659621 | C2/m (12) | ✔ | 15 | 90 | 3 | 2.8735 | 2.989 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2CdO2 | ICSD | 25004 | Pbcn (60) | ✔ | 20 | 168 | 2 | 1.4489 | 1.475 | 0.000 | (0;000) | ✗ | 02/02/17 |
K4CdP2 | ICSD | 61084 | R-3m (166) | ✔ | 7 | 58 | 1 | 0.89 | 0.963 | 0.000 | (0;000) | ✗ | 02/02/17 |
VCu3S4 | ICSD | 628945 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.0222 | 1.377 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaNiO3 | COD | 2106603 | P6_3/mmc (194) | ✔ | 10 | 76 | 1 | 1.1864 | 1.283 | 0.000 | (0;000) | ✗ | 05/01/17 |
Na2CdSn | COD | 7221227 | P6_3/mmc (194) | ✔ | 8 | 88 | 1 | 0.0 | 0.037 | 0.109 | (0;000) | ✗ | 02/02/17 |
Na4CdP2 | ICSD | 67262 | R-3m (166) | ✔ | 7 | 58 | 1 | 0.2097 | 0.314 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaY2NiO5 | COD | 2002505 | Immm (71) | ✔ | 9 | 72 | 3 | 0.0 | 0.009 | 0.438 | (0;000) | ✗ | 05/01/17 |
Rb2CdO2 | ICSD | 62054 | Pbcn (60) | ✔ | 20 | 168 | 3 | 1.5349 | 1.556 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSeO3 | COD | 2009816 | Pnma (62) | ✔ | 20 | 144 | 3 | 3.3067 | 3.472 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSO3 | ICSD | 62640 | P2_1/c (14) | ✔ | 20 | 144 | 3 | 3.5968 | 3.893 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSnO3 | ICSD | 165167 | Pnma (62) | ✔ | 20 | 176 | 3 | 1.0793 | 1.079 | 0.000 | (0;000) | ✗ | 02/02/17 |
VCu3S4 | ICSD | 628947 | P-43m (215) | ✗ | 8 | 70 | 3 | 0.938 | 1.282 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaO2 | COD | 2001842 | I4/mmm (139) | ✔ | 3 | 22 | 1 | 2.1926 | 2.193 | 0.000 | (0;000) | ✗ | 05/01/17 |
CdSe2O5 | COD | 2010004 | C2/c (15) | ✔ | 16 | 108 | 3 | 3.2062 | 3.475 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd | COD | 4030924 | P-1 (2) | ✔ | 1 | 12 | 1 | 4.3147 | 4.315 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdP4 | ICSD | 620212 | P2_1/c (14) | ✔ | 10 | 64 | 2 | 0.4513 | 0.519 | 0.000 | (0;000) | ✗ | 02/02/17 |
Zr5CdPb3 | ICSD | 604207 | P6_3/mcm (193) | ✔ | 18 | 148 | 3 | 0.0 | 0.001 | 0.980 | (0;000) | ✗ | 02/02/17 |
CdPS3 | ICSD | 620232 | C2/m (12) | ✔ | 10 | 70 | 2 | 1.6575 | 1.969 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdPSe3 | ICSD | 620234 | R-3 (148) | ✔ | 10 | 70 | 2 | 1.1098 | 1.259 | 0.000 | (0;000) | ✗ | 02/02/17 |
VCu3S4 | ICSD | 628955 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.021 | 1.375 | 0.000 | (0;000) | ✗ | 06/10/16 |
CdS2 | ICSD | 620305 | Pa3 (205) | ✔ | 12 | 96 | 3 | 0.6904 | 0.690 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sc2CdS4 | ICSD | 94994 | Fd-3m (227) | ✔ | 14 | 116 | 3 | 0.8989 | 0.899 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y2CdS4 | ICSD | 620371 | Fd-3m (227) | ✔ | 14 | 116 | 3 | 1.0639 | 1.064 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSb | COD | 9008881 | Pbca (61) | ✔ | 16 | 136 | 3 | 0.0 | 0.315 | 0.011 | (0;000) | ✗ | 02/02/17 |
TlCdSb | COD | 7222183 | Pnma (62) | ✔ | 12 | 120 | 3 | 0.0 | 0.171 | 0.117 | (0;000) | ✗ | 02/02/17 |
Sc2CdSe4 | ICSD | 620411 | Fd-3m (227) | ✔ | 14 | 116 | 3 | 0.2863 | 0.286 | 0.000 | (0;000) | ✗ | 02/02/17 |
CdSe2 | ICSD | 620416 | Pa3 (205) | ✔ | 12 | 96 | 3 | 0.4947 | 0.650 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y2CdSe4 | ICSD | 620457 | Fd-3m (227) | ✔ | 14 | 116 | 3 | 0.4534 | 0.453 | 0.000 | (0;000) | ✗ | 02/02/17 |
CF2 | ICSD | 151184 | P-1 (2) | ✔ | 18 | 108 | 1 | 5.2396 | 5.308 | 0.000 | (0;000) | ✗ | 02/02/17 |
CIF2 | COD | 7200677 | P2_1/c (14) | ✔ | 16 | 100 | 1 | 3.1528 | 3.212 | 0.000 | (0;000) | ✗ | 02/02/17 |
CIF3 | ICSD | 73268 | Cmce (64) | ✔ | 20 | 128 | 1 | 3.7955 | 3.808 | 0.000 | (0;000) | ✗ | 02/02/17 |
CS2NF5 | ICSD | 413754 | P-1 (2) | ✔ | 18 | 112 | 1 | 3.4262 | 3.430 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3CO3F | ICSD | 66028 | R-3c (167) | ✔ | 16 | 112 | 1 | 3.9679 | 3.968 | 0.000 | (0;000) | ✗ | 02/02/17 |
SnCSNF | ICSD | 2418 | Pnma (62) | ✔ | 20 | 144 | 2 | 2.7795 | 3.124 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb3CO3F | ICSD | 66029 | R-3c (167) | ✔ | 16 | 112 | 1 | 3.5487 | 3.549 | 0.000 | (0;000) | ✗ | 02/02/17 |
Tl3CO3F | ICSD | 2515 | P2_1/m (11) | ✔ | 16 | 136 | 3 | 2.157 | 2.424 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ge3Mo5C | ICSD | 42922 | P6_3/mcm (193) | ✔ | 18 | 172 | 3 | 0.0 | 0.002 | 0.844 | (0;000) | ✗ | 02/02/17 |
Y5Ge3C | ICSD | 617982 | P6_3/mcm (193) | ✔ | 18 | 142 | 3 | 0.0 | 0.000 | 0.603 | (0;000) | ✗ | 02/02/17 |
KAlH2CO5 | ICSD | 153303 | Cmcm (63) | ✔ | 20 | 96 | 2 | 4.9809 | 4.988 | 0.000 | (0;000) | ✗ | 02/02/17 |
BH2CO | ICSD | 9561 | C2/c (15) | ✔ | 20 | 60 | 1 | 1.1303 | 1.130 | 0.000 | (0;000) | ✗ | 02/02/17 |
H2CBr2 | COD | 2100676 | C2/c (15) | ✔ | 20 | 80 | 1 | 4.1172 | 4.203 | 0.000 | (0;000) | ✗ | 02/02/17 |
H2CCl2 | COD | 2100015 | Pbcn (60) | ✔ | 20 | 80 | 1 | 5.0549 | 5.126 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaH3CN4O | ICSD | 15874 | Pmma (51) | ✔ | 20 | 84 | 1 | 4.9832 | 4.985 | 0.000 | (0;000) | ✗ | 02/02/17 |
AgH4CN4 | COD | 2203531 | P-1 (2) | ✔ | 20 | 78 | 3 | 2.7572 | 3.110 | 0.000 | (0;000) | ✗ | 02/02/17 |
HCCl2 | COD | 7106717 | P2_1/c (14) | ✔ | 16 | 76 | 1 | 5.0857 | 5.162 | 0.000 | (0;000) | ✗ | 02/02/17 |
HCCl3 | COD | 7211802 | Pnma (62) | ✔ | 20 | 104 | 1 | 4.814 | 4.817 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsHCO2 | ICSD | 172202 | Pbcm (57) | ✔ | 20 | 104 | 1 | 4.4038 | 4.408 | 0.000 | (0;000) | ✗ | 02/02/17 |
HgCN2 | ICSD | 412278 | P2_1/c (14) | ✔ | 16 | 104 | 3 | 1.849 | 1.890 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaHCN2 | ICSD | 2495 | Pbcm (57) | ✔ | 20 | 96 | 1 | 4.265 | 4.266 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaOsO3 | ICSD | 237730 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 0.0 | 0.264 | 0.690 | (0;000) | ✗ | 05/01/17 |
RbHCO2 | ICSD | 172203 | Pbcm (57) | ✔ | 20 | 104 | 1 | 4.5929 | 4.593 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlHCO2 | ICSD | 110364 | Pnna (52) | ✔ | 20 | 120 | 1 | 3.0824 | 3.082 | 0.000 | (0;000) | ✗ | 02/02/17 |
HC | COD | 2100841 | Pa3 (205) | ✔ | 16 | 40 | 1 | 5.684 | 5.704 | 0.000 | (0;000) | ✗ | 02/02/17 |
Zr6CI12 | ICSD | 60918 | R-3 (148) | ✔ | 19 | 112 | 3 | 0.2079 | 0.289 | 0.000 | (0;000) | ✗ | 02/02/17 |
PtCI2O | ICSD | 68098 | C2/c (15) | ✔ | 20 | 136 | 2 | 1.6393 | 1.719 | 0.000 | (0;000) | ✗ | 02/02/17 |
KCSeN | ICSD | 23951 | P2_1/c (14) | ✔ | 16 | 96 | 1 | 2.9858 | 2.986 | 0.000 | (0;000) | ✗ | 02/02/17 |
KCO2 | COD | 4313233 | Pbam (55) | ✔ | 16 | 100 | 1 | 2.8207 | 2.821 | 0.000 | (0;000) | ✗ | 02/02/17 |
KCO3 | COD | 9010292 | P2_1/c (14) | ✔ | 20 | 124 | 1 | 0.4508 | 0.493 | 0.000 | (0;000) | ✗ | 02/02/17 |