[QE-users] Ph.x Raman Tensor Question

[Tang, Weilun]

Hi Quantum Espresso users:

I am studying the example 5 from PHonon. Below is the snippet of the output from ph.x.

These Raman tensors correspond to the atom and different polarization. Is there a way to find the Raman tensor corresponds to the vibrational modes?

Thanks for your time,

Weilun Tang

Department of Materials Science and Engineering
Iowa State University


------------------------------------------------------------------------------------------------------
Raman tensor (au^-1) in cartesian axis

           atom      1
          (      -0.000000000      -0.000000000       0.000000000 )
          (      -0.000000000      -0.000000000      -0.784974138 )
          (       0.000000000      -0.784974138       0.000000000 )

          (      -0.000000000       0.000000000      -0.784974138 )
          (       0.000000000       0.000000000      -0.000000000 )
          (      -0.784974138      -0.000000000      -0.000000000 )

          (       0.000000000      -0.784974138       0.000000000 )
          (      -0.784974138      -0.000000000      -0.000000000 )
          (       0.000000000      -0.000000000       0.000000000 )

           atom      2
          (      -0.000000000      -0.000000000       0.000000000 )
          (      -0.000000000      -0.000000000       0.793396465 )
          (      -0.000000000       0.793396465       0.000000000 )

          (       0.000000000      -0.000000000       0.793396465 )
          (      -0.000000000      -0.000000000       0.000000000 )
          (       0.793396465      -0.000000000       0.000000000 )

          (      -0.000000000       0.793396465      -0.000000000 )
          (       0.793396465      -0.000000000       0.000000000 )
          (       0.000000000       0.000000000      -0.000000000 )


-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20260101/2d288bad/attachment.html>