-
Notifications
You must be signed in to change notification settings - Fork 0
/
Cs3Bi2Br5I4.vasp
37 lines (36 loc) · 1.82 KB
/
Cs3Bi2Br5I4.vasp
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
vasp
1.00000000000000
8.1972673351864831 -0.0484048627814408 0.0728846099569721
-4.1405545335440710 7.0748387851157251 -0.0728846105743535
0.0900488147463608 -0.0519896991616985 10.0341711683424428
Bi Cs I Br
2 3 4 5
Direct
0.6738963481582334 0.3411874701943157 0.1754815233927079
0.3411874701943157 0.6738963481582334 0.8245184766073007
0.9846371762358411 0.9846371762358411 0.0000000000000000
0.6503092922648764 0.3372896866298705 0.6538763934421356
0.3372896866298705 0.6503092922648764 0.3461236065578977
0.3064320006697577 0.1347781312402589 0.3171032619265851
0.8285895029765695 0.1537834057605144 0.3352630348781386
0.1347781312402589 0.3064320006697648 0.6828967380734073
0.1537834057605144 0.8285895029765695 0.6647369651218363
0.5259335810634574 0.5259335810634574 0.0000000000000000
0.5653149302246824 0.0506405261737253 0.9607253609013663
0.0506405261737253 0.5653149302246824 0.0392746390986459
0.8017832985913804 0.6454246498165517 0.3466567168875627
0.6454246498165517 0.8017832985913804 0.6533432831124552
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00
0.00000000E+00 0.00000000E+00 0.00000000E+00