quantum-espresso/PHonon/examples/Recover_example/reference_1/elph_dir/a2Fq2r.57.7

30 lines
1.1 KiB
Groff

3.5000000000000003E-002 0.61042553517654896 2.4552261515711216
3
Dynamical Matrix in cartesian axes
q = ( 0.000000000 -1.000000000 0.000000000 )
1 1
0.05117351 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.16754777 0.00000000 -0.00000000 0.00000000
0.00000000 0.00000000 -0.00000000 0.00000000 0.05117351 0.00000000
Dynamical Matrix in cartesian axes
q = ( -1.000000000 0.000000000 0.000000000 )
1 1
0.16754777 0.00000000 -0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.05117351 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 -0.00000000 0.00000000 0.05117351 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 0.000000000 -1.000000000 )
1 1
0.05117351 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.05117351 0.00000000 -0.00000000 0.00000000
0.00000000 0.00000000 -0.00000000 0.00000000 0.16754777 0.00000000