▹ Formula |
▹ Source |
▹ ID |
▹ space group |
▹ centered |
▹ nat |
▹ ne |
▹ dim |
▹ gap |
▹ dir. gap |
▴ met. |
▹ ν |
wcc |
▹ updated |
NO2 |
ICSD |
28331 |
P2_1/c (14) |
✔ |
12 |
68 |
1 |
2.5717 |
2.624 |
0.000 |
(0;000) |
✗ |
27/01/17 |
AlPO4 |
ICSD |
280773 |
P2_1 (4) |
✗ |
12 |
64 |
3 |
5.6822 |
5.682 |
0.000 |
(0;000) |
✗ |
06/10/16 |
CdAs2 |
ICSD |
16037 |
I4_122 (98) |
✗ |
6 |
44 |
3 |
0.2887 |
0.909 |
0.000 |
(0;000) |
✔ |
06/10/16 |
SnSe |
ICSD |
71338 |
P4/nmm (129) |
✔ |
4 |
40 |
2 |
1.0615 |
1.067 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Na2AgAs |
ICSD |
49007 |
C222_1 (20) |
✗ |
8 |
68 |
1 |
0.6852 |
0.685 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Ga2Os |
ICSD |
103785 |
Fddd (70) |
✔ |
6 |
84 |
3 |
0.5627 |
0.794 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Ga2Ru |
ICSD |
635227 |
Fddd (70) |
✔ |
6 |
84 |
3 |
0.2122 |
0.894 |
0.000 |
(0;000) |
✗ |
06/10/16 |
BPO4 |
ICSD |
413437 |
I-4 (82) |
✗ |
6 |
32 |
3 |
7.731 |
7.958 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Ga2Te5 |
ICSD |
1085 |
I4/m (87) |
✔ |
7 |
56 |
3 |
0.8135 |
0.828 |
0.000 |
(0;000) |
✗ |
06/10/16 |
RuC |
ICSD |
181771 |
F-43m (216) |
✗ |
2 |
20 |
3 |
0.5257 |
0.839 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Al2CdS4 |
ICSD |
67218 |
I-4 (82) |
✗ |
7 |
42 |
3 |
2.9268 |
2.969 |
0.000 |
(0;000) |
✗ |
06/10/16 |
CuAgS |
ICSD |
66582 |
Pmc2_1 (26) |
✗ |
12 |
112 |
3 |
0.7416 |
0.819 |
0.000 |
(0;000) |
✗ |
06/10/16 |
AlPO4 |
ICSD |
98378 |
C222_1 (20) |
✗ |
12 |
64 |
3 |
5.7685 |
5.769 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Ag3SI |
ICSD |
93431 |
R3 (146) |
✗ |
5 |
46 |
3 |
0.4794 |
0.925 |
0.000 |
(0;000) |
✔ |
06/10/16 |
Nb2O5 |
ICSD |
25765 |
C2/m (12) |
✔ |
7 |
56 |
3 |
2.6685 |
3.191 |
0.000 |
(0;000) |
✗ |
27/01/17 |
GeO2 |
ICSD |
158598 |
Pmnn (58) |
✔ |
6 |
32 |
3 |
3.2329 |
3.286 |
0.000 |
(0;000) |
✗ |
06/10/16 |
SiC |
ICSD |
107204 |
P3m1 (156) |
✗ |
10 |
40 |
3 |
1.7282 |
2.854 |
0.000 |
(0;000) |
✗ |
06/10/16 |
AlPO4 |
ICSD |
98383 |
C222_1 (20) |
✗ |
12 |
64 |
3 |
5.7651 |
5.765 |
0.000 |
(0;000) |
✗ |
06/10/16 |
As2Ir |
ICSD |
42573 |
P2_1/c (14) |
✔ |
12 |
76 |
3 |
0.9232 |
1.038 |
0.000 |
(0;000) |
✗ |
06/10/16 |
GeS |
ICSD |
1256 |
Pmcn (62) |
✔ |
8 |
40 |
2 |
1.1038 |
1.104 |
0.000 |
(0;000) |
✗ |
06/10/16 |
NiO2 |
ICSD |
88720 |
C2/m (12) |
✔ |
3 |
22 |
2 |
0.9834 |
1.142 |
0.000 |
(0;000) |
✗ |
06/10/16 |
GeSe |
ICSD |
17006 |
Pmcn (62) |
✔ |
8 |
40 |
2 |
0.5998 |
0.700 |
0.000 |
(0;000) |
✗ |
06/10/16 |
GeSe |
ICSD |
637852 |
Pmnb (62) |
✔ |
8 |
40 |
2 |
0.6476 |
0.829 |
0.000 |
(0;000) |
✗ |
06/10/16 |
NiP2 |
ICSD |
27160 |
C2/c (15) |
✔ |
6 |
40 |
3 |
0.5384 |
0.618 |
0.000 |
(0;000) |
✗ |
06/10/16 |
SiC |
ICSD |
24168 |
R3m (160) |
✗ |
10 |
40 |
3 |
1.9506 |
3.262 |
0.000 |
(0;000) |
✗ |
06/10/16 |
PbO |
ICSD |
62846 |
P4/nmm (129) |
✔ |
4 |
40 |
2 |
1.1693 |
2.163 |
0.000 |
(0;000) |
✗ |
06/10/16 |
MnP4 |
ICSD |
100786 |
P-1 (2) |
✔ |
10 |
70 |
3 |
0.3988 |
0.496 |
0.000 |
(0;000) |
✗ |
06/10/16 |
BaTiO3 |
ICSD |
73641 |
C2mm (38) |
✗ |
5 |
40 |
3 |
2.1532 |
2.468 |
0.000 |
(0;000) |
✗ |
06/10/16 |
SnC |
ICSD |
182365 |
F-43m (216) |
✗ |
2 |
18 |
3 |
0.4951 |
0.495 |
0.000 |
(0;000) |
✔ |
06/10/16 |
Ag2HgI4 |
ICSD |
25592 |
I-4 (82) |
✗ |
7 |
62 |
3 |
1.0077 |
1.008 |
0.000 |
(0;000) |
✗ |
06/10/16 |
PbSe |
ICSD |
648514 |
Pnma (62) |
✔ |
8 |
80 |
3 |
0.6688 |
0.905 |
0.000 |
(0;000) |
✗ |
02/02/17 |
PI2 |
ICSD |
203216 |
P-1 (2) |
✔ |
6 |
38 |
1 |
1.5597 |
1.560 |
0.000 |
(0;000) |
✗ |
06/10/16 |
ZrC |
ICSD |
183162 |
F-43m (216) |
✗ |
2 |
16 |
3 |
0.3943 |
0.467 |
0.000 |
(0;000) |
✔ |
06/10/16 |
BPO4 |
ICSD |
150378 |
I-4 (82) |
✗ |
6 |
32 |
3 |
7.6596 |
7.782 |
0.000 |
(0;000) |
✗ |
06/10/16 |
As2Se3 |
ICSD |
611373 |
C2/m (12) |
✔ |
10 |
56 |
1 |
0.5143 |
0.533 |
0.000 |
(0;000) |
✗ |
30/01/17 |
InS |
ICSD |
15931 |
Pnnm (58) |
✔ |
8 |
76 |
3 |
0.6548 |
1.429 |
0.000 |
(0;000) |
✗ |
27/01/17 |
BaC2 |
ICSD |
88102 |
C2/c (15) |
✔ |
6 |
36 |
1 |
1.9008 |
2.015 |
0.000 |
(0;000) |
✗ |
27/01/17 |
AlPS4 |
ICSD |
428185 |
I222 (23) |
✗ |
6 |
32 |
1 |
2.5158 |
2.670 |
0.000 |
(0;000) |
✗ |
06/10/16 |
PbO |
ICSD |
36250 |
Pbc2_1 (29) |
✗ |
8 |
80 |
3 |
1.6145 |
1.935 |
0.000 |
(0;000) |
✗ |
06/10/16 |
BaTiO3 |
ICSD |
73636 |
R3m (160) |
✗ |
5 |
40 |
3 |
2.3575 |
2.655 |
0.000 |
(0;000) |
✗ |
06/10/16 |
PbO |
ICSD |
99777 |
P1 (1) |
✗ |
8 |
80 |
2 |
0.9824 |
0.982 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Te3As2 |
ICSD |
18208 |
C2/m (12) |
✔ |
10 |
56 |
2 |
0.3627 |
0.397 |
0.000 |
(0;000) |
✔ |
06/10/16 |
CaC2 |
ICSD |
24074 |
C2/c (15) |
✔ |
6 |
36 |
1 |
2.3901 |
2.972 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Tl3AsS3 |
ICSD |
100292 |
R3m (160) |
✗ |
7 |
62 |
3 |
0.8209 |
0.911 |
0.000 |
(0;000) |
✗ |
06/10/16 |
SnO |
ICSD |
424729 |
Ccm2_1 (36) |
✗ |
8 |
80 |
2 |
1.2884 |
1.479 |
0.000 |
(0;000) |
✗ |
06/10/16 |
CaC2 |
ICSD |
290833 |
C2/m (12) |
✔ |
6 |
36 |
1 |
2.378 |
2.794 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Tl2O |
ICSD |
77699 |
C2/m (12) |
✔ |
6 |
64 |
1 |
0.402 |
0.482 |
0.000 |
(0;000) |
✔ |
06/10/16 |
SnSe |
ICSD |
186650 |
Pmnb (62) |
✔ |
8 |
80 |
2 |
0.4992 |
0.652 |
0.000 |
(0;000) |
✗ |
06/10/16 |
ZnO |
ICSD |
154486 |
P6_3mc (186) |
✗ |
4 |
36 |
3 |
0.7686 |
0.769 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Sn2IF3 |
ICSD |
2419 |
C222_1 (20) |
✗ |
12 |
112 |
1 |
2.2326 |
2.389 |
0.000 |
(0;000) |
✗ |
06/10/16 |
Plotting...