quantum-espresso/PHonon/examples/Recover_example/reference_1/elph_dir/a2Fq2r.55.3

39 lines
1.4 KiB
Groff

2.5000000000000001E-002 0.61135159280271389 2.3298032981725334
4
Dynamical Matrix in cartesian axes
q = ( 0.500000000 -0.500000000 0.500000000 )
1 1
0.05584842 0.00000000 -0.03899875 0.00000000 0.03899875 0.00000000
-0.03899875 0.00000000 0.05584842 0.00000000 -0.03899875 0.00000000
0.03899875 0.00000000 -0.03899875 0.00000000 0.05584842 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.500000000 0.500000000 )
1 1
0.05584842 0.00000000 0.03899875 0.00000000 0.03899875 0.00000000
0.03899875 0.00000000 0.05584842 0.00000000 0.03899875 0.00000000
0.03899875 0.00000000 0.03899875 0.00000000 0.05584842 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.500000000 0.500000000 )
1 1
0.05584842 0.00000000 -0.03899875 0.00000000 -0.03899875 0.00000000
-0.03899875 0.00000000 0.05584842 0.00000000 0.03899875 0.00000000
-0.03899875 0.00000000 0.03899875 0.00000000 0.05584842 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.500000000 -0.500000000 )
1 1
0.05584842 0.00000000 0.03899875 0.00000000 -0.03899875 0.00000000
0.03899875 0.00000000 0.05584842 0.00000000 -0.03899875 0.00000000
-0.03899875 0.00000000 -0.03899875 0.00000000 0.05584842 0.00000000