Bilbao Crystallographic Server
IR Raman Hyper-Raman Modes
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Choose the Wyckoff Positions of the atoms in your structure for the space group
P
4
/m
m
m
(No. 123)
Check
WP
Representative
16u
x,y,z
8t
x,1/2,z
8s
x,0,z
8r
x,x,z
8q
x,y,1/2
8p
x,y,0
4o
x,1/2,1/2
4n
x,1/2,0
4m
x,0,1/2
4l
x,0,0
4k
x,x,1/2
4j
x,x,0
4i
0,1/2,z
2h
1/2,1/2,z
2g
0,0,z
2f
0,1/2,0
2e
0,1/2,1/2
1d
1/2,1/2,1/2
1c
1/2,1/2,0
1b
0,0,1/2
1a
0,0,0
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