DIOPSIDE [102], structure type -
diopside
, at 1atm
Atomic Positions
N/N
x/a
y/b
z/c
B(j)
Occupancy
1
0.0000
0.9081
0.2500
0.3100
Mg
2
0.0000
0.3015
0.2500
0.6500
Ca
3
0.2862
0.0932
0.2294
0.3400
Si
4
0.1155
0.0869
0.1419
0.5500
O
5
0.3609
0.2502
0.3178
0.6200
O
6
0.3507
0.0174
0.9954
0.5600
O