quantum-espresso/PHonon/examples/Recover_example/reference_1/elph_dir/a2Fq2r.54.6

111 lines
4.1 KiB
Groff

2.0000000000000000E-002 0.61182623156463212 2.2497391926057739
12
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.000000000 0.500000000 )
1 1
0.14745699 0.00000000 0.00000000 0.00000000 0.13710263 0.00000000
-0.00000000 -0.00000000 0.05453541 0.00000000 -0.00000000 -0.00000000
0.13710263 0.00000000 0.00000000 0.00000000 0.14745699 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.000000000 0.500000000 )
1 1
0.14745699 0.00000000 0.00000000 -0.00000000 -0.13710263 -0.00000000
0.00000000 0.00000000 0.05453541 -0.00000000 0.00000000 -0.00000000
-0.13710263 -0.00000000 0.00000000 0.00000000 0.14745699 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.000000000 -0.500000000 )
1 1
0.14745699 0.00000000 0.00000000 0.00000000 0.13710263 0.00000000
-0.00000000 0.00000000 0.05453541 0.00000000 -0.00000000 0.00000000
0.13710263 0.00000000 0.00000000 0.00000000 0.14745699 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.000000000 -0.500000000 )
1 1
0.14745699 0.00000000 0.00000000 -0.00000000 -0.13710263 -0.00000000
0.00000000 -0.00000000 0.05453541 -0.00000000 0.00000000 0.00000000
-0.13710263 -0.00000000 0.00000000 0.00000000 0.14745699 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 0.500000000 -0.500000000 )
1 1
0.05453541 0.00000000 0.00000000 -0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.14745699 0.00000000 -0.13710263 0.00000000
0.00000000 -0.00000000 -0.13710263 0.00000000 0.14745699 0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 0.500000000 0.000000000 )
1 1
0.14745699 0.00000000 -0.13710263 -0.00000000 0.00000000 -0.00000000
-0.13710263 -0.00000000 0.14745699 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.00000000 -0.00000000 0.05453541 -0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 0.500000000 0.500000000 )
1 1
0.05453541 -0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 -0.00000000 0.14745699 0.00000000 0.13710263 0.00000000
0.00000000 -0.00000000 0.13710263 0.00000000 0.14745699 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 -0.500000000 -0.500000000 )
1 1
0.05453541 -0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 -0.00000000 0.14745699 0.00000000 0.13710263 0.00000000
0.00000000 -0.00000000 0.13710263 0.00000000 0.14745699 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 0.500000000 0.000000000 )
1 1
0.14745699 0.00000000 0.13710263 0.00000000 0.00000000 0.00000000
0.13710263 0.00000000 0.14745699 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.00000000 0.00000000 0.05453541 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.500000000 -0.500000000 0.000000000 )
1 1
0.14745699 0.00000000 -0.13710263 -0.00000000 0.00000000 -0.00000000
-0.13710263 -0.00000000 0.14745699 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.00000000 -0.00000000 0.05453541 -0.00000000
Dynamical Matrix in cartesian axes
q = ( -0.500000000 -0.500000000 0.000000000 )
1 1
0.14745699 0.00000000 0.13710263 0.00000000 0.00000000 0.00000000
0.13710263 0.00000000 0.14745699 0.00000000 0.00000000 0.00000000
-0.00000000 0.00000000 0.00000000 0.00000000 0.05453541 0.00000000
Dynamical Matrix in cartesian axes
q = ( 0.000000000 -0.500000000 0.500000000 )
1 1
0.05453541 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
0.00000000 0.00000000 0.14745699 0.00000000 -0.13710263 0.00000000
0.00000000 0.00000000 -0.13710263 0.00000000 0.14745699 0.00000000