quantum-espresso/PHonon/examples/Recover_example/reference_1/elph_dir/a2Fq2r.55.6

111 lines
4.1 KiB
Groff

2.5000000000000001E-002 0.61135159280271389 2.3298032981725334
12
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.000000000 0.500000000 )
1 1
0.12114275 0.00000000 0.00000000 -0.00000000 0.11196193 0.00000000
0.00000000 0.00000000 0.05615995 0.00000000 0.00000000 0.00000000
0.11196193 0.00000000 0.00000000 -0.00000000 0.12114275 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.000000000 0.500000000 )
1 1
0.12114275 0.00000000 0.00000000 0.00000000 -0.11196193 -0.00000000
0.00000000 0.00000000 0.05615995 0.00000000 -0.00000000 -0.00000000
-0.11196193 -0.00000000 -0.00000000 -0.00000000 0.12114275 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.000000000 -0.500000000 )
1 1
0.12114275 0.00000000 0.00000000 0.00000000 0.11196193 0.00000000
0.00000000 0.00000000 0.05615995 0.00000000 0.00000000 0.00000000
0.11196193 0.00000000 0.00000000 0.00000000 0.12114275 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.000000000 -0.500000000 )
1 1
0.12114275 0.00000000 0.00000000 0.00000000 -0.11196193 -0.00000000
0.00000000 0.00000000 0.05615995 0.00000000 -0.00000000 -0.00000000
-0.11196193 -0.00000000 -0.00000000 -0.00000000 0.12114275 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 0.500000000 -0.500000000 )
1 1
0.05615995 0.00000000 -0.00000000 0.00000000 0.00000000 -0.00000000
0.00000000 -0.00000000 0.12114275 0.00000000 -0.11196193 0.00000000
0.00000000 0.00000000 -0.11196193 0.00000000 0.12114275 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.500000000 0.000000000 )
1 1
0.12114275 0.00000000 -0.11196193 -0.00000000 0.00000000 0.00000000
-0.11196193 -0.00000000 0.12114275 0.00000000 -0.00000000 -0.00000000
0.00000000 0.00000000 -0.00000000 -0.00000000 0.05615995 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 0.500000000 0.500000000 )
1 1
0.05615995 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.12114275 0.00000000 0.11196193 0.00000000
0.00000000 0.00000000 0.11196193 0.00000000 0.12114275 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 -0.500000000 -0.500000000 )
1 1
0.05615995 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.12114275 0.00000000 0.11196193 0.00000000
0.00000000 0.00000000 0.11196193 0.00000000 0.12114275 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.500000000 0.000000000 )
1 1
0.12114275 0.00000000 0.11196193 0.00000000 0.00000000 0.00000000
0.11196193 0.00000000 0.12114275 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 -0.00000000 0.00000000 0.05615995 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 -0.500000000 0.000000000 )
1 1
0.12114275 0.00000000 -0.11196193 -0.00000000 0.00000000 0.00000000
-0.11196193 -0.00000000 0.12114275 0.00000000 -0.00000000 -0.00000000
0.00000000 0.00000000 -0.00000000 -0.00000000 0.05615995 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 -0.500000000 0.000000000 )
1 1
0.12114275 0.00000000 0.11196193 0.00000000 0.00000000 0.00000000
0.11196193 0.00000000 0.12114275 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 -0.00000000 0.00000000 0.05615995 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 -0.500000000 0.500000000 )
1 1
0.05615995 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.12114275 0.00000000 -0.11196193 0.00000000
0.00000000 0.00000000 -0.11196193 0.00000000 0.12114275 0.00000000