quantum-espresso/PHonon/examples/Recover_example/reference_1/elph_dir/a2Fq2r.53.7

30 lines
1.1 KiB
Groff

1.4999999999999999E-002 0.61214241437908834 2.1232294890908663
3
Dynamical Matrix in cartesian axes
q = ( 0.000000000 -1.000000000 0.000000000 )
1 1
0.06131965 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 0.17625980 0.00000000 -0.00000000 0.00000000
0.00000000 0.00000000 -0.00000000 0.00000000 0.06131965 0.00000000
Dynamical Matrix in cartesian axes
q = ( -1.000000000 0.000000000 0.000000000 )
1 1
0.17625980 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.06131965 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 0.00000000 0.00000000 0.06131965 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 0.000000000 -1.000000000 )
1 1
0.06131965 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 0.06131965 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 -0.00000000 0.00000000 0.17625980 0.00000000