quantum-espresso/PHonon/examples/Recover_example/reference_1/elph_dir/a2Fq2r.59.6

111 lines
4.1 KiB
Groff

4.4999999999999998E-002 0.60970150371491094 2.5529662038079124
12
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.000000000 0.500000000 )
1 1
0.09712138 0.00000000 0.00000000 0.00000000 0.08791585 0.00000000
-0.00000000 -0.00000000 0.06361921 0.00000000 0.00000000 -0.00000000
0.08791585 0.00000000 0.00000000 0.00000000 0.09712138 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.000000000 0.500000000 )
1 1
0.09712138 0.00000000 0.00000000 -0.00000000 -0.08791585 -0.00000000
-0.00000000 0.00000000 0.06361921 -0.00000000 -0.00000000 -0.00000000
-0.08791585 -0.00000000 0.00000000 0.00000000 0.09712138 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.000000000 -0.500000000 )
1 1
0.09712138 0.00000000 0.00000000 0.00000000 0.08791585 0.00000000
-0.00000000 0.00000000 0.06361921 0.00000000 0.00000000 0.00000000
0.08791585 0.00000000 0.00000000 0.00000000 0.09712138 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.000000000 -0.500000000 )
1 1
0.09712138 0.00000000 0.00000000 -0.00000000 -0.08791585 -0.00000000
-0.00000000 -0.00000000 0.06361921 -0.00000000 -0.00000000 0.00000000
-0.08791585 -0.00000000 0.00000000 0.00000000 0.09712138 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 0.500000000 -0.500000000 )
1 1
0.06361921 0.00000000 0.00000000 -0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.09712138 0.00000000 -0.08791585 0.00000000
-0.00000000 -0.00000000 -0.08791585 0.00000000 0.09712138 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.500000000 0.000000000 )
1 1
0.09712138 0.00000000 -0.08791585 -0.00000000 0.00000000 -0.00000000
-0.08791585 -0.00000000 0.09712138 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 -0.00000000 -0.00000000 0.06361921 -0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 0.500000000 0.500000000 )
1 1
0.06361921 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000
-0.00000000 -0.00000000 0.09712138 0.00000000 0.08791585 0.00000000
0.00000000 -0.00000000 0.08791585 0.00000000 0.09712138 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 -0.500000000 -0.500000000 )
1 1
0.06361921 -0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 -0.00000000 0.09712138 0.00000000 0.08791585 0.00000000
0.00000000 -0.00000000 0.08791585 0.00000000 0.09712138 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.500000000 0.000000000 )
1 1
0.09712138 0.00000000 0.08791585 0.00000000 0.00000000 0.00000000
0.08791585 0.00000000 0.09712138 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 0.00000000 0.00000000 0.06361921 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 -0.500000000 0.000000000 )
1 1
0.09712138 0.00000000 -0.08791585 -0.00000000 0.00000000 -0.00000000
-0.08791585 -0.00000000 0.09712138 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.00000000 -0.00000000 0.06361921 -0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 -0.500000000 0.000000000 )
1 1
0.09712138 0.00000000 0.08791585 0.00000000 0.00000000 0.00000000
0.08791585 0.00000000 0.09712138 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 0.00000000 0.00000000 0.06361921 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 -0.500000000 0.500000000 )
1 1
0.06361921 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.09712138 0.00000000 -0.08791585 0.00000000
-0.00000000 0.00000000 -0.08791585 0.00000000 0.09712138 0.00000000