≤nAtoms≤
≤nElements≤
Space Group:
≤ Gap ≤
≤ Dir. Gap ≤
≤ Met. ≤
Formula
Composition
(ν0,ν1ν2ν3)
Source ID

13628 materials founds

▹ Formula ▴ Source ▹ ID ▹ space group ▹ centered ▹ nat ▹ ne ▹ dim ▹ gap ▹ dir. gap ▹ met. ▹ ν wcc ▹ updated
NaClO3 COD 1001127 P2_1/c (14) ✔ 20 136 1 4.8842 4.976 0.000 (0;000) ✗ 02/02/17
LiClO2 COD 2014617 P4_2/ncm (138) ✔ 16 88 1 2.6354 2.635 0.000 (0;000) ✗ 02/02/17
KClO3 COD 2310654 Pnma (62) ✔ 20 136 1 3.1985 3.200 0.000 (0;000) ✗ 02/02/17
LiH2ClO COD 2201759 Cmcm (63) ✔ 20 72 1 5.5527 5.579 0.000 (0;000) ✗ 02/02/17
GaTeCl COD 7221395 Pnnm (58) ✔ 12 104 2 2.0533 2.053 0.000 (0;000) ✗ 02/02/17
Na6S2ClO8F COD 1011182 Fm-3m (225) ✔ 18 128 1 4.6318 4.636 0.000 (0;000) ✗ 02/02/17
SbClF8 COD 1533112 P-1 (2) ✔ 20 136 1 3.0697 3.115 0.000 (0;000) ✗ 02/02/17
CuCl COD 9013927 Pa3 (205) ✔ 16 144 3 0.5672 0.567 0.000 (0;000) ✗ 02/02/17
CuHgSeCl COD 1001109 Pbam (55) ✔ 16 144 3 0.868 0.874 0.000 (0;000) ✗ 02/02/17
Tl2SnCl6 COD 1010177 Fm-3m (225) ✔ 9 82 1 2.9112 2.911 0.000 (0;000) ✗ 02/02/17
Rb2ZrCl6 COD 1010223 Fm-3m (225) ✔ 9 64 1 3.5199 3.520 0.000 (0;000) ✗ 02/02/17
Rb2TeCl6 COD 1010232 Fm-3m (225) ✔ 9 66 2 2.5055 2.733 0.000 (0;000) ✗ 02/02/17
Rb2SnCl6 COD 1010175 Fm-3m (225) ✔ 9 74 1 2.7072 2.707 0.000 (0;000) ✗ 02/02/17
Tl2PtCl6 COD 1010239 Fm-3m (225) ✔ 9 78 1 1.619 1.664 0.000 (0;000) ✗ 02/02/17
Rb2PtCl6 COD 1010237 Fm-3m (225) ✔ 9 70 1 1.7119 1.712 0.000 (0;000) ✗ 02/02/17
Na3YCl6 COD 9007973 P2_1/c (14) ✔ 20 160 1 5.2619 5.281 0.000 (0;000) ✗ 02/02/17
Te(NCl3)2 COD 9016366 Fm-3m (225) ✔ 9 58 2 0.0 0.003 0.652 (0;000) ✗ 02/02/17
CrBO3 COD 2310093 R-3c (167) ✔ 10 70 3 0.0 0.000 0.476 (0;000) ✗ 05/01/17
Cr2B COD 1009055 I4/mcm (140) ✔ 6 62 3 0.0 0.000 0.611 (1;000) ✗ 05/01/17
CoReB COD 1511055 Pnma (62) ✔ 12 140 3 0.0 0.001 0.512 (0;011) ✗ 05/01/17
CoB COD 9008945 Pnma (62) ✔ 8 80 3 0.0 0.039 0.086 (0;000) ✗ 05/01/17
CoBMo COD 1511054 Pnma (62) ✔ 12 136 3 0.0 0.006 0.231 (0;000) ✗ 05/01/17
YCo4B COD 1511072 P6/mmm (191) ✔ 12 164 3 0.0 0.005 0.493 (1;000) ✗ 05/01/17
K2PtCl6 COD 2105522 Fm-3m (225) ✔ 9 70 1 1.611 1.611 0.000 (0;000) ✗ 02/02/17
Co2B COD 1511063 I4/mcm (140) ✔ 6 74 3 0.0 0.000 0.445 (1;111) ✗ 05/01/17
SnH8(NCl3)2 COD 9013381 Fm-3m (225) ✔ 17 74 1 2.5738 2.574 0.000 (0;000) ✗ 02/02/17
CsWCl6 COD 1527332 C2/c (15) ✔ 16 130 1 0.0 0.002 0.475 (1;010) ✗ 02/02/17
CaNi4B COD 8103479 P6/mmm (191) ✔ 12 106 3 0.0 0.001 0.746 (1;000) ✗ 05/01/17
Ca3BN3 COD 1511018 P4/mmm (123) ✔ 7 48 1 0.4803 0.491 0.000 (0;000) ✗ 05/01/17
Cs2SnCl6 COD 1010228 Fm-3m (225) ✔ 9 74 1 2.8166 2.817 0.000 (0;000) ✗ 02/02/17
Cs2SeCl6 COD 1010222 Fm-3m (225) ✔ 9 66 1 2.598 2.786 0.000 (0;000) ✗ 02/02/17
Be4B COD 1511458 P4/nmm (129) ✔ 10 38 1 0.0 0.000 0.827 (0;001) ✗ 05/01/17
Cs2MoCl6 COD 8102884 Fm-3m (225) ✔ 9 74 1 0.0 0.000 0.190 (0;000) ✗ 02/02/17
BaNaBO3 COD 2003991 C2/m (12) ✔ 12 80 1 3.8607 3.861 0.000 (0;000) ✗ 05/01/17
MoCl5 COD 2101942 P-1 (2) ✔ 12 98 1 0.0 0.004 0.377 (1;111) ✗ 02/02/17
Cs3CoCl5 COD 2011750 I4/mcm (140) ✔ 18 158 1 0.0 0.000 0.321 (0;111) ✗ 02/02/17
ReCl4 COD 4123951 P2/c (13) ✔ 20 172 1 0.0 0.032 0.088 (0;000) ✗ 02/02/17
BaTe COD 9008602 Fm-3m (225) ✔ 2 16 1 1.2448 1.616 0.000 (0;000) ✗ 05/01/17
PbCl4 COD 9007926 C2/c (15) ✔ 10 84 1 2.1044 2.104 0.000 (0;000) ✗ 02/02/17
BaS COD 9008600 Fm-3m (225) ✔ 2 16 1 2.0979 2.188 0.000 (0;000) ✗ 05/01/17
BaZnSn COD 1527804 P6_3/mmc (194) ✔ 6 72 2 0.0 0.002 0.266 (1;000) ✗ 05/01/17
Pd(NCl2)2 COD 9015430 P4/mmm (123) ✔ 7 56 1 0.0 0.001 0.522 (0;000) ✗ 02/02/17
BaZnSi COD 1527803 P6_3/mmc (194) ✔ 6 52 2 0.0 0.001 0.295 (0;000) ✗ 05/01/17
BaSi COD 1526652 Cmcm (63) ✔ 4 28 1 0.0 0.012 0.130 (0;110) ✗ 05/01/17
K2PtCl4 COD 1010083 P4/mmm (123) ✔ 7 56 1 1.5056 1.537 0.000 (0;000) ✗ 02/02/17
BaSi2 COD 1527353 P-3m1 (164) ✔ 3 18 2 0.0 0.020 0.229 (0;001) ✗ 05/01/17
BaSe COD 9008601 Fm-3m (225) ✔ 2 16 1 1.7784 1.971 0.000 (0;000) ✗ 05/01/17
Rb2CuCl4 COD 1528214 Cmce (64) ✔ 14 114 2 0.0 0.000 0.938 (0;000) ✗ 02/02/17
BaSe2 COD 7221479 C2/c (15) ✔ 6 44 1 1.009 1.076 0.000 (0;000) ✗ 05/01/17
Cs2PtCl4 COD 9009288 Cmcm (63) ✔ 14 112 1 1.8445 1.845 0.000 (0;000) ✗ 02/02/17
Cs2PdCl4 COD 1532216 P4/mmm (123) ✔ 7 64 1 1.6208 1.621 0.000 (0;000) ✗ 02/02/17
BaPt COD 4113101 P6_3/mmc (194) ✔ 4 40 3 0.0 0.001 0.150 (0;000) ✗ 05/01/17
RbVCl3 COD 1530068 P6_3/mmc (194) ✔ 10 86 1 0.0 0.000 0.711 (0;000) ✗ 02/02/17
RbNiCl3 COD 1527092 P6_3/mmc (194) ✔ 10 80 1 0.0 0.003 0.206 (0;000) ✗ 02/02/17
NbSeCl3 COD 2209086 P2/c (13) ✔ 20 160 1 0.7005 0.816 0.000 (0;000) ✗ 02/02/17
MoSeCl3 COD 4002056 C2/c (15) ✔ 20 164 1 0.0 0.005 0.471 (1;110) ✗ 02/02/17
MoCl3O COD 1527307 P2_1/c (14) ✔ 20 164 1 0.0 0.005 0.067 (0;010) ✗ 02/02/17
BaZnPb COD 1527802 P6_3/mmc (194) ✔ 6 72 2 0.0 0.007 0.168 (1;000) ✗ 05/01/17
ICl3 COD 4336764 P-1 (2) ✔ 8 56 1 1.572 1.573 0.000 (0;000) ✗ 02/02/17
KCuCl3 COD 1528208 P2_1/c (14) ✔ 20 164 1 0.0 0.004 0.065 (0;000) ✗ 02/02/17
Ba(ZnP)2 COD 7221353 I4/mmm (139) ✔ 5 44 2 0.0 0.286 0.109 (0;000) ✗ 05/01/17
CsSnCl3 COD 1527954 P2_1/c (14) ✔ 20 176 1 2.8109 2.811 0.000 (0;000) ✗ 02/02/17
CsScCl3 COD 4343633 P6_3/mmc (194) ✔ 10 82 1 0.0 0.000 0.596 (0;000) ✗ 02/02/17
Cr(ClO2)3 COD 9016332 R-3c (167) ✔ 20 142 3 0.0 0.021 1.000 (0;000) ✗ 02/02/17
BaZnSO COD 4310117 Cmcm (63) ✔ 8 68 2 2.2859 2.344 0.000 (0;000) ✗ 05/01/17
SnCl2 COD 2310517 Pnma (62) ✔ 12 112 1 2.9786 3.228 0.000 (0;000) ✗ 02/02/17
BaO COD 1527735 P4/nmm (129) ✔ 4 32 3 1.9651 1.965 0.000 (0;000) ✗ 05/01/17
BaO COD 1011362 Fm-3m (225) ✔ 2 16 1 1.8783 1.878 0.000 (0;000) ✗ 05/01/17
Nb(SeCl)2 COD 1522780 P-1 (2) ✔ 10 78 2 0.9448 1.031 0.000 (0;000) ✗ 02/02/17
Ba COD 9008528 Im-3m (229) ✔ 1 10 1 0.0 0.000 0.399 (0;000) ✗ 05/01/17
Ba COD 1507757 Pm-3m (221) ✔ 1 10 3 0.0 0.000 0.092 (0;000) ✗ 05/01/17
Zn(NCl)2 COD 9015876 Imma (74) ✔ 10 72 1 0.0 0.000 0.771 (1;000) ✗ 02/02/17
Pt(NCl)2 COD 9014307 P4/m (83) ✔ 10 68 3 0.0 0.009 0.422 (1;000) ✗ 02/02/17
BaSn(PO4)2 COD 7001616 C2/m (12) ✔ 12 82 2 4.3034 4.396 0.000 (0;000) ✗ 05/01/17
Ba(SbO3)2 COD 2009658 P-31m (162) ✔ 9 56 2 3.3588 3.441 0.000 (0;000) ✗ 05/01/17
BaZrO3 COD 1532743 Pm-3m (221) ✔ 5 32 3 2.7993 2.799 0.000 (0;000) ✗ 05/01/17
CuH4(ClO)2 COD 1008760 Pmna (53) ✔ 18 82 1 0.0 0.000 0.821 (0;000) ✗ 02/02/17
BaTiO3 COD 5910149 Pm-3m (221) ✔ 5 40 3 1.8554 1.915 0.000 (0;000) ✗ 05/01/17
KC COD 1521141 I4_1/acd (142) ✔ 16 104 1 3.3837 3.412 0.000 (0;000) ✗ 02/02/17
BaTeO3 COD 1524714 P2_1/m (11) ✔ 10 68 1 2.8465 2.873 0.000 (0;000) ✗ 05/01/17
KCO2 COD 4313233 Pbam (55) ✔ 16 100 1 2.8207 2.821 0.000 (0;000) ✗ 02/02/17
BaSiO3 COD 9010192 R-3m (166) ✔ 15 96 3 3.4421 3.543 0.000 (0;000) ✗ 05/01/17
HCO2 COD 5900034 P2_1/c (14) ✔ 16 68 1 0.0 0.011 0.058 (1;010) ✗ 02/02/17
BaPbO3 COD 1528128 Imma (74) ✔ 10 84 3 0.1566 0.157 0.000 (0;000) ✗ 05/01/17
H2CBr2 COD 2100676 C2/c (15) ✔ 20 80 1 4.1172 4.203 0.000 (0;000) ✗ 02/02/17
TlCdSb COD 7222183 Pnma (62) ✔ 12 120 3 0.0 0.171 0.117 (0;000) ✗ 02/02/17
CdSb COD 9008881 Pbca (61) ✔ 16 136 3 0.0 0.315 0.011 (0;000) ✗ 02/02/17
BaO2 COD 2001842 I4/mmm (139) ✔ 3 22 1 2.1926 2.193 0.000 (0;000) ✗ 05/01/17
BaNiS2 COD 4123984 P4/nmm (129) ✔ 8 64 2 0.0 0.020 0.175 (0;001) ✗ 05/01/17
BaY2NiO5 COD 2002505 Immm (71) ✔ 9 72 3 0.0 0.009 0.438 (0;000) ✗ 05/01/17
BaNiO3 COD 2106603 P6_3/mmc (194) ✔ 10 76 1 1.1864 1.283 0.000 (0;000) ✗ 05/01/17
BaNiO2 COD 1527692 Cmcm (63) ✔ 8 64 2 0.0 0.025 0.027 (0;000) ✗ 05/01/17
Cd(InS2)2 COD 9012323 Fd-3m (227) ✔ 14 124 3 1.4147 1.507 0.000 (0;000) ✗ 02/02/17
Ba(SiNi)2 COD 7221340 Cmcm (63) ✔ 10 76 3 0.0 0.019 0.577 (1;000) ✗ 05/01/17
CdGeO3 COD 1530775 C2/c (15) ✔ 20 136 3 1.7048 1.761 0.000 (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
BaV2(NiO4)2 COD 2002114 R-3 (148) ✔ 13 104 2 0.0154 0.027 0.000 (0;111) ✗ 05/01/17
BaNi2(PO4)2 COD 2008469 R-3 (148) ✔ 13 88 2 0.0 0.007 0.116 (0;000) ✗ 05/01/17
Cs2CdCl4 COD 2310671 I4/mmm (139) ✔ 7 58 2 3.4013 3.913 0.000 (0;000) ✗ 02/02/17
K2Cd2O3 COD 1528164 P2_1/c (14) ✔ 14 120 3 0.7106 0.711 0.000 (0;000) ✗ 02/02/17